Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5332076

C=C(C)C(=O)NCCC[N+](C)(C)CC(=O)OCC.[Cl-]

nearest known ligand 0.38

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 18)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.32
GAA P10253 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.34
ATM Q13315 1/20 0.32
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 2/20 0.30
CBLB Q13191 1/20 0.30

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
SCHEMBL14443968 0.99 GAA (0.39) GAAMGAMSIMGAM2KMT2A
Hydrochloric Acid SCHEMBL2124456 0.87 KMT2A (0.34) KMT2AATMHTTCBLB
SCHEMBL13415944 0.85 KMT2A (0.35) GAAMGAMSIMGAM2KMT2A
Hydrochloric Acid SCHEMBL153335 0.81 KMT2A (0.35) KMT2AKDM4EATMACHELMNA
Hydrochloric Acid SCHEMBL6117375 0.81 BBOX1 (0.42) KMT2AKDM4EATMRAD52ACHE
SCHEMBL154890 0.79 KMT2A (0.36) KMT2AKDM4EATMLMNAALDH1A1
SCHEMBL19484356 0.79 BBOX1 (0.37) KMT2AKDM4EATMCBLB
Hydrochloric Acid SCHEMBL31536719 0.79 DNM1 (0.39) KMT2AATMACHEHTTTSHR
SCHEMBL22116247 0.79 ZDHHC20 (0.47) GAAMGAMSIMGAM2KMT2A
SCHEMBL3764634 0.79 BBOX1 (0.43) KMT2AKDM4EATMRAD52HTT

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
EP-1539676-B1 MONOMER COMPOUND COMPRISING SEVERAL CATIONIC GROUPS, PROCESS FOR MAKING THE SAME, AND POLYMERS COMPRISING UNITS DERIVING THEREFROM SOLVAY USA INC (US) 2017-07-26 EP disclosed
EP-2644592-A1 Monomer compound comprising several cationic groups, process for making the same, and polymers comprising units deriving therefrom RHODIA INC. (US) 2013-10-02 EP disclosed
US-7247693-B2 Monomer compound comprising several cationic groups, process for making the same, and polymers comprising units deriving therefrom RHODIA INC. (US) 2007-07-24 US disclosed
EP-1539676-A4 MONOMER COMPOUND COMPRISING SEVERAL CATIONIC GROUPS, PROCESS FOR MAKING THE SAME, AND POLYMERS COMPRISING UNITS DERIVING THEREFROM RHODIA (US) 2007-02-21 EP disclosed
US-20060111533-A1 Monomer compound comprising several cationic groups, process for making the same, and polymers comprising units deriving therefrom RHODIA OPERATIONS (FR) 2006-05-25 US disclosed
US-7030275-B2 Monomer compound comprising several cationic groups, process for making the same, and polymers comprising units deriving therefrom RHODIA INC. (US) 2006-04-18 US disclosed
EP-1539676-A1 MONOMER COMPOUND COMPRISING SEVERAL CATIONIC GROUPS, PROCESS FOR MAKING THE SAME, AND POLYMERS COMPRISING UNITS DERIVING THEREFROM Rhodia Inc. (US) 2005-06-15 EP disclosed
US-20040010106-A1 Monomer compound comprising several cationic groups, process for making the same, and polymers comprising units deriving therefrom RHODIA OPERATIONS (FR) 2004-01-15 US disclosed
WO-2003101935-A1 MONOMER COMPOUND COMPRISING SEVERAL CATIONIC GROUPS, PROCESS FOR MAKING THE SAME, AND POLYMERS COMPRISING UNITS DERIVING THEREFROM RHODIA INC. (US) 2003-12-11 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 (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-20040010106-A1 Monomer compound comprising several cationic groups, process for making the same, and polymers comprising units deriving therefrom PCNA, PBRM1, B2M ACHE 3600/4885GAA 4211/4885MGAM 1696/4885

“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.