Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1044115

CCC1=C(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CCC(=O)O)C(CCC(=O)O)=C4C)c(C)c3CC.Cl.Cl

nearest known ligand 0.62

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
HDAC1 known ✓ Q13547 3/20 0.33
EGFR known ✓ P00533 2/20 0.33
HSD17B10 Q99714 3/20 0.62
TDP1 Q9NUW8 3/20 0.62
MEN1 O00255 2/20 0.62
MAPT P10636 2/20 0.62
THRB P10828 2/20 0.62
MAPK1 P28482 2/20 0.62
KMT2A Q03164 2/20 0.62
APEX1 P27695 2/20 0.62
USP2 O75604 1/20 0.62
LMNA P02545 1/20 0.62
CYP1A2 P05177 1/20 0.62
POLB P06746 1/20 0.62
CYP2D6 P10635 1/20 0.62
HSPD1 P10809 1/20 0.62
CYP2C9 P11712 1/20 0.62
HPGD P15428 1/20 0.62
ALOX15 P16050 1/20 0.62
NFKB1 P19838 1/20 0.62

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 SCHEMBL1044825 1.00 HSD17B10 (0.62) HSD17B10TDP1MEN1MAPTTHRB
Hydrochloric Acid SCHEMBL1042399 1.00 HSD17B10 (0.62) HSD17B10TDP1MEN1MAPTTHRB
Hydrochloric Acid SCHEMBL3287063 0.99 HSD17B10 (0.61) HSD17B10TDP1MEN1MAPTTHRB
Hydrochloric Acid SCHEMBL6414612 0.99 HSD17B10 (0.61) HSD17B10TDP1MEN1MAPTTHRB
Hydrochloric Acid SCHEMBL3292729 0.99 HSD17B10 (0.61) HSD17B10TDP1MEN1MAPTTHRB
SCHEMBL314687 0.99 HSD17B10 (0.63) HSD17B10TDP1MEN1MAPTTHRB
SCHEMBL5447002 0.99 HSD17B10 (0.63) HSD17B10TDP1MEN1MAPTTHRB
SCHEMBL9609762 0.99 HSD17B10 (0.63) HSD17B10TDP1MEN1MAPTTHRB
SCHEMBL6413992 0.99 HSD17B10 (0.63) HSD17B10TDP1MEN1MAPTTHRB
SCHEMBL1602877 0.98 HSD17B10 (0.62) HSD17B10TDP1MEN1MAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11078220-B2 High-purity large-scale preparation of stannsoporfin Mallinckrodt Hospital Products IP Limited (IE) 2021-08-03 US claimed
CN-111693691-A Polymer label based on porphyrin structure 天津华科泰生物技术有限公司 2020-09-22 CN claimed
US-20200255458-A1 HIGH-PURITY LARGE-SCALE PREPARATION OF STANNSOPORFIN MALLINCKRODT LLC 2020-08-13 US claimed
US-10533024-B2 Methods for synthesizing metal mesoporphyrins MALLINCKRODT HOSPTIAL PRODUCTS IP LIMITED (IE) 2020-01-14 US claimed
US-10273255-B2 High-purity large-scale preparation of stannsoporfin INFACARE PHARMACEUTICAL CORPORATION (US) 2019-04-30 US claimed
US-20190002481-A1 METHODS FOR SYNTHESIZING METAL MESOPORPHYRINS SpecGx LLC 2019-01-03 US claimed
US-20180134735-A1 HIGH-PURITY LARGE-SCALE PREPARATION OF STANNSOPORFIN MALLINCKRODT LLC 2018-05-17 US claimed
US-9902745-B2 High-purity large-scale preparation of stannsoporfin INFACARE PHARMACEUTICAL CORPORATION (US) 2018-02-27 US claimed
US-20170260217-A1 METHODS FOR SYNTHESIZING METAL MESOPORPHYRINS MALLINCKRODT ENTERPRISES LLC 2017-09-14 US claimed
US-9688705-B2 Methods for synthesizing metal mesoporphyrins INFACARE PHARMACEUTICAL CORPORATION (US) 2017-06-27 US claimed
CN-101573122-A High purity large scale preparation of stannsoporfin INFACARE PHARMACEUTICAL CORP (US) 2009-11-04 CN claimed
EP-2079472-A2 HIGH-PURITY LARGE-SCALE PREPARATION OF STANNSOPORFIN InfaCare Pharmaceutical Corporation (US) 2009-07-22 EP claimed
US-20080125585-A1 HIGH-PURITY LARGE-SCALE PREPARATION OF STANNSOPORFIN STRATATECH CORPORATION 2008-05-29 US claimed
US-7375216-B2 Preparation of metal mesoporphyrin compounds INFACARE PHARMACEUTICAL CORPORATION (US) 2008-05-20 US claimed
WO-2008045377-A2 HIGH-PURITY LARGE-SCALE PREPARATION OF STANNSOPORFIN INFACARE PHARMACEUTICAL CORPORATION (US) 2008-04-17 WO claimed
JP-2007530676-A 2007-11-01 JP claimed
EP-1730150-A2 PREPARATION OF METAL MESOPORPHYRIN HALIDE COMPOUNDS Wellspring Pharmaceutical Corporation (US) 2006-12-13 EP claimed
WO-2005103056-A2 PREPARATION OF METAL MESOPORPHYRIN HALIDE COMPOUNDS WELLSPRING PHARMACEUTICAL CORPORATION (US) 2005-11-03 WO claimed
US-20040210048-A1 Preparation of metal mesoporphyrin halide compounds WELLSPRING PHARMACEUTICAL CORPORATION 2004-10-21 US claimed
EP-0337598-A2 Use of porphyrins and metalloporphyrins in the treatment of diseases caused by Human Immunodeficiency Viruses GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1989-10-18 EP claimed

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

For each of this compound's patents that has machine-readable text (5 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-20180134735-A1 HIGH-PURITY LARGE-SCALE PREPARATION OF STANNSOPORFIN SNRPF, HNRNPF, NUP188 HDAC1 2667/4885EGFR 1970/4885HSD17B10 2207/4885
US-20080125585-A1 HIGH-PURITY LARGE-SCALE PREPARATION OF STANNSOPORFIN SNRPF, HNRNPF, NUP188 HDAC1 2667/4885EGFR 1970/4885HSD17B10 2207/4885
US-10273255-B2 High-purity large-scale preparation of stannsoporfin SNRPF, HNRNPF, NUP188 HDAC1 2667/4885EGFR 1970/4885HSD17B10 2207/4885
US-20200255458-A1 HIGH-PURITY LARGE-SCALE PREPARATION OF STANNSOPORFIN SNRPF, HNRNPF, NUP188 HDAC1 2667/4885EGFR 1970/4885HSD17B10 2207/4885
US-11078220-B2 High-purity large-scale preparation of stannsoporfin SNRPF, HNRNPF, NUP188 HDAC1 2667/4885EGFR 1970/4885HSD17B10 2207/4885

“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.