Hydrochloric Acid

Hydrochloric Acid

SCHEMBL174859

CC(Cl)CNCCc1ccc(Cl)cc1.Cl

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA known ✓ P10253 1/20 0.47
CA2 known ✓ P00918 1/20 0.44
KCNH2 known ✓ Q12809 1/20 0.43
ADRB2 known ✓ P07550 1/20 0.42
ADRB1 known ✓ P08588 1/20 0.42
ADRB3 known ✓ P13945 1/20 0.42
TAAR1 Q96RJ0 2/20 0.55
KMT2A Q03164 6/20 0.47
MEN1 O00255 4/20 0.47
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA4 P22748 1/20 0.44
CA9 Q16790 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
IDO1 P14902 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL28087267 1.00 TAAR1 (0.55) TAAR1GAAKMT2AMEN1CA12
SCHEMBL938702 0.98 TAAR1 (0.57) TAAR1GAAKMT2AMEN1CA12
SCHEMBL28087397 0.98 TAAR1 (0.57) TAAR1GAAKMT2AMEN1CA12
Oxalic Acid SCHEMBL27962691 0.89 GAA (0.52) TAAR1GAAKMT2AMEN1SMN1; SMN2
SCHEMBL13801229 0.87 TAAR1 (0.53) TAAR1GAAKMT2AMEN1CA12
SCHEMBL13644447 0.87 TAAR1 (0.57) TAAR1GAAKMT2AMEN1CA12
Hydrochloric Acid SCHEMBL3770898 0.86 TAAR1 (0.52) TAAR1GAAKMT2AMEN1MAPT
SCHEMBL12574171 0.84 TAAR1 (0.53) TAAR1GAAKMT2AMEN1CA12
SCHEMBL937041 0.84 TAAR1 (0.53) TAAR1GAAKMT2AMEN1MAPT
SCHEMBL23374696 0.82 TAAR1 (0.52) TAAR1GAAKMT2AMEN1CA12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822727-B2 Processes for the preparation of intermediates related to the 5-HT2C agonist (R)-8-chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine ARENA PHARMACEUTICALS, INC. (US) 2014-09-02 US claimed
EP-2518053-A1 PROCESS FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE Arena Pharmaceuticals, Inc. (US) 2012-10-31 EP claimed
US-8168782-B2 synthesis of lorcaserin ARENA PHARMACEUTICALS, INC. (US) 2012-05-01 US claimed
JP-2011513402-A 2011-04-28 JP claimed
EP-2288585-A1 PROCESSES FOR THE PREPARATION OF INTERMEDIATES RELATED TO THE 5-HT2C AGONIST (R)-8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE Arena Pharmaceuticals, Inc. (US) 2011-03-02 EP claimed
US-20110015438-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES RELATED TOTHE 5-HT2C AGONIST (R)-8-CHLORO-1-METHYL-2,3,4,5,-TETRAHYDRO-1H-3-BENZAZEPINE ARENA PHARMACEUTICALS, INC. 2011-01-20 US claimed
WO-2009111004-A1 PROCESSES FOR THE PREPARATION OF INTERMEDIATES RELATED TO THE 5-HT2C AGONIST (R)-8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE ARENA PHARMACEUTICALS, INC. (US) 2009-09-11 WO claimed
US-20090143576-A1 Processes for the Preparation of 8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine and Intermediates Related Thereto ARENA PHARMACEUTICALS, INC. 2009-06-04 US claimed
EP-2001852-A2 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-17 EP claimed
WO-2007120517-A2 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO claimed
US-10463676-B2 Modified-release dosage forms of 5-HT2C agonists useful for weight management ARENA PHARMACEUTICALS, INC. (US) 2019-11-05 US disclosed
US-20190275055-A1 Modified-Release Dosage Forms of 5-Ht2c Agonists Useful for Weight Management ARENA PHARMACEUTICALS, INC. 2019-09-12 US disclosed
EP-3485878-A1 MODIFIED-RELEASE DOSAGE FORMS OF 5-HT2C AGONISTS USEFUL FOR WEIGHT MANAGEMENT Arena Pharmaceuticals, Inc. (US) 2019-05-22 EP disclosed
US-10226471-B2 Modified-release dosage forms of 5-HT2C agonists useful for weight management ARENA PHARMACEUTICALS, INC. (US) 2019-03-12 US disclosed
EP-2611427-B1 MODIFIED-RELEASE DOSAGE FORMS OF 5-HT2C AGONISTS USEFUL FOR WEIGHT MANAGEMENT ARENA PHARM INC (US) 2018-10-17 EP disclosed
US-20100305316-A1 PROCESSES FOR PREPARING (R)-8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES THEREOF ARENA PHARMACEUTICALS, INC. 2010-12-02 US disclosed
WO-2009111004-A1 PROCESSES FOR THE PREPARATION OF INTERMEDIATES RELATED TO THE 5-HT2C AGONIST (R)-8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE ARENA PHARMACEUTICALS, INC. (US) 2009-09-11 WO disclosed
US-20090143576-A1 Processes for the Preparation of 8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine and Intermediates Related Thereto ARENA PHARMACEUTICALS, INC. 2009-06-04 US disclosed
EP-2001852-A2 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-17 EP disclosed
WO-2007120517-A2 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10463676-B2 Modified-release dosage forms of 5-HT2C agonists useful for weight management HTR2C, HTR2A, HTR3C GAA 2568/4885CA2 2618/4885KCNH2 795/4885
US-10226471-B2 Modified-release dosage forms of 5-HT2C agonists useful for weight management HTR2C, HTR2A, HTR3C GAA 2568/4885CA2 2618/4885KCNH2 795/4885
US-20090143576-A1 Processes for the Preparation of 8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine and Intermediates Related Thereto HTR2C, HTR3C, HTR1A GAA 2708/4885CA2 2797/4885KCNH2 623/4885
US-20190275055-A1 Modified-Release Dosage Forms of 5-Ht2c Agonists Useful for Weight Management HTR2C, HTR2A, HTR3C GAA 2568/4885CA2 2618/4885KCNH2 795/4885
US-20110015438-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES RELATED TOTHE 5-HT2C AGONIST (R)-8-CHLORO-1-METHYL-2,3,4,5,-TETRAHYDRO-1H-3-BENZAZEPINE HTR2C, HTR3C, HTR3A GAA 2965/4885CA2 3891/4885KCNH2 371/4885
US-20100305316-A1 PROCESSES FOR PREPARING (R)-8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES THEREOF HTR2C, HTR3C, HTR3B GAA 2376/4885CA2 3351/4885KCNH2 333/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.