Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5566560

CN1CC[N+](C)(CCCOc2ccc(N)cc2N)CC1.[Cl-]

nearest known ligand 0.48

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
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 2/20 0.48
USP2 O75604 1/20 0.48
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
CASP1 P29466 1/20 0.48
HTT P42858 1/20 0.48
CASP7 P55210 1/20 0.48
ATM Q13315 1/20 0.48
PRSS1 P07477 8/20 0.34
ADRA2C P18825 1/20 0.33
EHMT2 Q96KQ7 1/20 0.32
EHMT1 Q9H9B1 1/20 0.32
HTR7 P34969 1/20 0.32
HTR6 P50406 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL2927526 0.99 MEN1 (0.49) MEN1ALDH1A1KMT2AKDM4EMAPT
Hydrochloric Acid SCHEMBL7739978 0.97 KDM4E (0.49) MEN1ALDH1A1KMT2AKDM4EMAPT
Hydrochloric Acid SCHEMBL7739976 0.96 KDM4E (0.50) MEN1ALDH1A1KMT2AKDM4EMAPT
SCHEMBL16807231 0.92 KDM4E (0.50) MEN1ALDH1A1KMT2AKDM4EMAPT
Hydrochloric Acid SCHEMBL6150986 0.89 GAA (0.55) MEN1ALDH1A1KMT2AKDM4EMAPT
SCHEMBL2928557 0.88 GAA (0.57) MEN1ALDH1A1KMT2AKDM4EMAPT
Hydrochloric Acid SCHEMBL7741352 0.87 KDM4E (0.44) MEN1ALDH1A1KMT2AKDM4EMAPT
Hydrochloric Acid SCHEMBL5567515 0.87 HTT (0.53) MEN1ALDH1A1KMT2AKDM4EMAPT
SCHEMBL2930520 0.85 KDM4E (0.54) MEN1ALDH1A1KMT2AKDM4EMAPT
SCHEMBL15567545 0.84 KDM4E (0.53) MEN1ALDH1A1KMT2AKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1064252-B1 OXIDATION DYEING COMPOSITIONS CONTAINING A CATIONIC COUPLING AGENT, NOVEL CATIONIC COUPLING AGENTS OREAL (FR) 2005-06-15 EP claimed
US-6419711-B1 PHENOLIC COMPOUND COUPLER L'OREAL (FR) 2002-07-16 US claimed
US-7229479-B2 Method of coloring porous material CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-06-12 US disclosed
US-20060162095-A1 Method of colouring porous material CIBA SPECIALTY CHEMICALS CORP. 2006-07-27 US disclosed
EP-1534226-A1 METHOD OF COLOURING POROUS MATERIAL Ciba SC Holding AG (CH) 2005-06-01 EP disclosed
WO-2004019897-A1 METHOD OF COLOURING POROUS MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-03-11 WO disclosed
US-6419711-B1 PHENOLIC COMPOUND COUPLER L'OREAL (FR) 2002-07-16 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 (1 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-20060162095-A1 Method of colouring porous material ACR, HLA-C, TYR MEN1 615/4885ALDH1A1 2989/4885KMT2A 3603/4885

“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.