Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3843750

C[c+]1n(C)ccn1CC(=O)Nc1ccccc1F.[Cl-]

nearest known ligand 0.53

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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.53
POLB P06746 4/20 0.52
ALDH1A1 P00352 8/20 0.52
L3MBTL1 Q9Y468 2/20 0.49
HPGD P15428 2/20 0.49
KDM4E B2RXH2 2/20 0.49
HTT P42858 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
RCE1 Q9Y256 1/20 0.49
HSD17B10 Q99714 1/20 0.48
NPC1 O15118 2/20 0.48
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
GAA P10253 2/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
RAB9A P51151 1/20 0.46
GFER P55789 1/20 0.46

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 SCHEMBL3847742 0.86 CYP3A4 (0.42) TSHRPOLBALDH1A1L3MBTL1TDP1
Hydrochloric Acid SCHEMBL3844292 0.84 RAB9A (0.49) POLBHTTHSD17B10NPC1MAPT
Bromide SCHEMBL3844291 0.83 HPGD (0.52) POLBALDH1A1L3MBTL1HPGDHTT
Hydrochloric Acid SCHEMBL3849815 0.82 SCN1A (0.50) ALDH1A1KDM4EHTTNPC1MAPT
Hydrochloric Acid SCHEMBL3853175 0.74 KMT2A (0.50) ALDH1A1L3MBTL1HPGDKDM4EHTT
Bromide SCHEMBL3845569 0.73 CES2 (0.38) TSHRALDH1A1KDM4EHTTTDP1
SCHEMBL2010247 0.72 SMN1; SMN2 (0.69) TSHRPOLBALDH1A1HPGDHTT
Hydrochloric Acid SCHEMBL3844650 0.71 ALOX15 (0.53) TSHRPOLBALDH1A1L3MBTL1HPGD
Hydrochloric Acid SCHEMBL3845924 0.71 MAPT (0.47) TSHRKDM4ENPC1MAPTCYP3A4
SCHEMBL1063418 0.71 NPSR1 (0.71) TSHRPOLBALDH1A1HTTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085086-A2 Method for treating congestive heart failure or diabetic nephropathy Synvista Therapeutics, Inc. (US) 2009-08-05 EP disclosed
US-20090124673-A1 Method for treating diabetic nephropathy SYNVISTA THERAPEUTICS , INC. (US) 2009-05-14 US disclosed
US-20090124674-A1 Method for treating congestive heart failure SYNVISTA THERAPEUTICS, INC. (US) 2009-05-14 US disclosed
US-7432254-B2 Method for treating glaucoma IC SYNVISTA THERAPEUTICS, INC. (US) 2008-10-07 US disclosed
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents SYNVISTA THERAPEUTICS, INC. 2007-02-22 US disclosed
US-7166625-B2 Method for treating fibrotic diseases and other indications ALTEON, INC. (US) 2007-01-23 US disclosed
EP-1305024-A4 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON INC (US) 2006-03-22 EP disclosed
US-20040235837-A1 Method for treating fibrotic diseases or other indications IE SYNVISTA THERAPEUTICS, INC. 2004-11-25 US disclosed
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents ALTEON, INC. 2003-09-18 US disclosed
EP-1305024-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC Alteon, Inc. (US) 2003-05-02 EP disclosed
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID SYNVISTA THERAPEUTICS, INC. 2002-11-28 US disclosed
US-20020160993-A1 Method for treating glaucoma IC SYNVISTA THERAPEUTICS, INC. 2002-10-31 US disclosed
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC ALTEON, INC. 2002-06-06 US disclosed
WO-2002007725-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON, INC. (US) 2002-01-31 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 (8 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-20040235837-A1 Method for treating fibrotic diseases or other indications IE MMP1, COL1A1, COL2A1 TSHR 3360/4885POLB 2072/4885ALDH1A1 175/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 TSHR 3214/4885POLB 3857/4885ALDH1A1 366/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 TSHR 3040/4885POLB 2130/4885ALDH1A1 204/4885
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, COL2A1 TSHR 2797/4885POLB 3175/4885ALDH1A1 192/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 TSHR 3825/4885POLB 3981/4885ALDH1A1 402/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 TSHR 2851/4885POLB 1901/4885ALDH1A1 261/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX TSHR 1545/4885POLB 3600/4885ALDH1A1 431/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 TSHR 3017/4885POLB 4353/4885ALDH1A1 448/4885

“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.