Hydrochloric Acid

Hydrochloric Acid

SCHEMBL816946

CCCC(=O)N(Cc1ccccc1)[Nd+]N(Cc1ccccc1)C(=O)CCC.[Cl-]

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
TP53 P04637 1/20 0.47
KMT2A Q03164 4/20 0.46
LMNA P02545 1/20 0.45
OPRM1 P35372 1/20 0.44
MEN1 O00255 3/20 0.43
LTB4R2 Q9NPC1 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
ALOX5 P09917 1/20 0.41
TSPO P30536 1/20 0.41

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
Iodide SCHEMBL817556 0.97 NPC1 (0.50) NPC1RAB9ATP53KMT2ALMNA
Fluoride Ion SCHEMBL817566 0.97 NPC1 (0.50) NPC1RAB9ATP53KMT2ALMNA
Bromide SCHEMBL817582 0.97 NPC1 (0.50) NPC1RAB9ATP53KMT2ALMNA
Hydrochloric Acid SCHEMBL817990 0.86 NPC1 (0.49) NPC1RAB9AKMT2ALMNAOPRM1
Fluoride Ion SCHEMBL817671 0.83 NPC1 (0.49) NPC1RAB9AKMT2ALMNAOPRM1
Iodide SCHEMBL817230 0.83 NPC1 (0.49) NPC1RAB9AKMT2ALMNAOPRM1
Bromide SCHEMBL817740 0.83 NPC1 (0.49) NPC1RAB9AKMT2ALMNAOPRM1
SCHEMBL2720763 0.79 LMNA (0.59) NPC1RAB9ATP53KMT2ALMNA
SCHEMBL1690816 0.77 NPC1 (0.82) NPC1RAB9ATP53KMT2AMEN1
SCHEMBL17333350 0.76 NPC1 (0.53) NPC1RAB9ATP53KMT2ALMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153545-B2 Process for homo—or copolymerization of conjugated olefins STYRON EUROPE GMBH (CH) 2012-04-10 US disclosed
US-20110160041-A1 PROCESS FOR HOMO - OR COPOLYMERIZATION OF CONJUGATED OLEFINS STYRON EUROPE GMBH 2011-06-30 US disclosed
US-7915194-B2 Process for homo- or copolymerization of conjugated olefins STYRON EUROPE GMBH (CH) 2011-03-29 US disclosed
EP-2267046-A1 Process for homo- or copolymerization of conjugated olefines DOW GLOBAL TECHNOLOGIES INC. (US) 2010-12-29 EP disclosed
US-20100248947-A1 PROCESS FOR HOMO - OR COPOLYMERIZATION OF CONJUGATED OLEFINS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-09-30 US disclosed
US-7612009-B2 Process for homo-or copolymerization of conjugated olefines DOW GLOBAL TECHNOLOGIES, INC. (US) 2009-11-03 US disclosed
US-20060142145-A1 Process for homo-or copolymerization of conjugated olefines TRINSEO EUROPE GMBH (CH) 2006-06-29 US disclosed
EP-1597292-A2 PROCESS FOR HOMO- OR COPOLYMERIZATION OF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2005-11-23 EP disclosed
WO-2004076504-A2 PROCESS FOR HOMO- OR COPOLYMERIZATION OF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES, INC. (US) 2004-09-10 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 (2 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-20110160041-A1 PROCESS FOR HOMO - OR COPOLYMERIZATION OF CONJUGATED OLEFINS F12, ETFB, F2 NPC1 3338/4885RAB9A 4044/4885TP53 4774/4885
US-20060142145-A1 Process for homo-or copolymerization of conjugated olefines ETFB, F12, F2 NPC1 3771/4885RAB9A 2984/4885TP53 4739/4885

“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.