Hydrochloric Acid

Hydrochloric Acid

SCHEMBL616304

CCOC(=O)C(=O)Nc1ccc(Cl)cn1.Cl

nearest known ligand 0.64

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
GLA known ✓ P06280 1/20 0.53
ADRA2A known ✓ P08913 1/20 0.52
ADRA2B known ✓ P18089 1/20 0.52
ADRA2C known ✓ P18825 1/20 0.52
NPSR1 Q6W5P4 2/20 0.64
MAPT P10636 3/20 0.60
ALDH1A1 P00352 3/20 0.60
PTK2 Q05397 1/20 0.56
RAB9A P51151 7/20 0.56
L3MBTL1 Q9Y468 4/20 0.55
TDP1 Q9NUW8 1/20 0.55
NPC1 O15118 4/20 0.53
MAPK1 P28482 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.52
TP53 P04637 2/20 0.52
TSHR P16473 2/20 0.52
NFKB1 P19838 2/20 0.52
NFKB2 Q00653 2/20 0.52
RELA Q04206 2/20 0.52
CYP1A2 P05177 1/20 0.52

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 SCHEMBL30054295 1.00 NPSR1 (0.64) NPSR1MAPTALDH1A1PTK2RAB9A
SCHEMBL4687835 0.99 NPSR1 (0.65) NPSR1MAPTALDH1A1PTK2RAB9A
SCHEMBL29538166 0.99 NPSR1 (0.65) NPSR1MAPTALDH1A1PTK2RAB9A
Hydrochloric Acid SCHEMBL30722380 0.85 PTK2 (0.63) MAPTALDH1A1PTK2RAB9AL3MBTL1
Hydrochloric Acid SCHEMBL26987783 0.85 PTK2 (0.63) MAPTALDH1A1PTK2RAB9AL3MBTL1
SCHEMBL18869281 0.84 NPSR1 (0.62) NPSR1MAPTALDH1A1PTK2RAB9A
SCHEMBL10046419 0.84 RAB9A (0.70) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL30481206 0.83 PTK2 (0.65) MAPTALDH1A1PTK2RAB9AL3MBTL1
SCHEMBL1503835 0.83 PTK2 (0.65) MAPTALDH1A1PTK2RAB9AL3MBTL1
SCHEMBL11732416 0.82 MAPT (0.63) MAPTALDH1A1RAB9AL3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4631932-A1 PREPARATION METHOD FOR EDOXABAN AND INTERMEDIATE THEREOF Zhejiang Huahai Pharmaceutical Co., Ltd. (CN) 2025-10-15 EP disclosed
WO-2024120275-A1 PREPARATION METHOD FOR EDOXABAN AND INTERMEDIATE THEREOF 浙江华海药业股份有限公司 2024-06-13 WO disclosed
CN-118146145-A Preparation method of ideoxaban and intermediate thereof 浙江华海药业股份有限公司 2024-06-07 CN disclosed
EP-3752488-B1 METHOD FOR PREPARING TERT-BUTYL N-((1R,2S,5S)-2-((2-((5-CHLOROPYRIDIN-2-YL)AMINO)-2-OXOACETYL)AMINO)-5-(DIMETHYLCARBAMOYL)CYCLOHEXYL)CARBAMATE MOEHS IBERICA SL (ES) 2023-03-08 EP disclosed
EP-3752488-A1 METHOD FOR PREPARING TERT-BUTYL N-((1R,2S,5S)-2-((2-((5-CHLOROPYRIDIN-2-YL)AMINO)-2-OXOACETYL)AMINO)-5-(DIMETHYLCARBAMOYL)CYCLOHEXYL)CARBAMATE Moehs Ibérica, S.L. (ES) 2020-12-23 EP disclosed
WO-2019158550-A1 METHOD FOR PREPARING TERT-BUTYL N-((1R,2S,5S)-2-((2-((5-CHLOROPYRIDIN-2-YL)AMINO)-2-OXOACETYL)AMINO)-5-(DIMETHYLCARBAMOYL)CYCLOHEXYL)CARBAMATE MOEHS IBERICA, S.L. (ES) 2019-08-22 WO disclosed
US-10301322-B2 Processes for the preparation of edoxaban and intermediates thereof APOTEX INC. (CA) 2019-05-28 US disclosed
US-20180179226-A1 Processes for the Preparation of Edoxaban and Intermediates Thereof THE BANK OF NOVA SCOTIA (CA) 2018-06-28 US disclosed
US-9809546-B2 Process for producing diamine derivative Chungwha Chemical Synthesis & Biotech Co., Ltd. (TW) 2017-11-07 US disclosed
US-20170260138-A1 PROCESS FOR PRODUCING DIAMINE DERIVATIVE CHUNGHWA CHEMICAL SYNTHESIS & BIOTECH CO. LTD. (TW) 2017-09-14 US disclosed
EP-2589590-B1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE DIAMINE DERIVATIVE SALT DAIICHI SANKYO CO LTD (JP) 2016-12-28 EP disclosed
US-9447118-B2 Preparation method of optically active diamine compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-09-20 US disclosed
EP-2980067-A1 PROCESSES FOR PREPARING OPTICALLY ACTIVE DIAMINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-02-03 EP disclosed
US-20160016974-A1 PREPARATION METHOD OF OPTICALLY ACTIVE DIAMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-01-21 US disclosed
EP-2407457-B1 PROCESS FOR PRODUCING DIAMINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2015-04-22 EP disclosed
US-8901345-B2 Process for preparation of optically active diamine derivative salt DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-12-02 US disclosed
US-20130165657-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE DIAMINE DERIVATIVE SALT DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-06-27 US disclosed
EP-2589590-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE DIAMINE DERIVATIVE SALT DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-05-08 EP disclosed
US-8357808-B2 Process for producing diamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-01-22 US disclosed
US-20120041206-A1 PROCESS FOR PRODUCING DIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-16 US 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-20120041206-A1 PROCESS FOR PRODUCING DIAMINE DERIVATIVE TFPI, TFPI2, DAO GLA 1785/4885ADRA2A 4453/4885ADRA2B 4577/4885
US-20130165657-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE DIAMINE DERIVATIVE SALT TFPI, F12, TFPI2 GLA 835/4885ADRA2A 4456/4885ADRA2B 4416/4885
US-20160016974-A1 PREPARATION METHOD OF OPTICALLY ACTIVE DIAMINE COMPOUND F12, F8, F11 GLA 258/4885ADRA2A 2124/4885ADRA2B 3544/4885
US-20170260138-A1 PROCESS FOR PRODUCING DIAMINE DERIVATIVE DDT, ODC1, DDC GLA 2795/4885ADRA2A 1948/4885ADRA2B 1786/4885
US-10301322-B2 Processes for the preparation of edoxaban and intermediates thereof VKORC1, CYP2C9, VKORC1L1 GLA 1134/4885ADRA2A 520/4885ADRA2B 777/4885
US-20180179226-A1 Processes for the Preparation of Edoxaban and Intermediates Thereof VKORC1, CYP2C9, VKORC1L1 GLA 1134/4885ADRA2A 520/4885ADRA2B 777/4885

“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.