Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3479356

C=CCc1cccc[n+]1CCCC.[Cl-]

nearest known ligand 0.40

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
ACHE known ✓ P22303 2/20 0.33
SMN1; SMN2 Q16637 7/20 0.40
NPC1 O15118 7/20 0.40
RAB9A P51151 6/20 0.40
KDM4E B2RXH2 6/20 0.40
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
HTT P42858 5/20 0.40
NPSR1 Q6W5P4 3/20 0.40
MAPK1 P28482 3/20 0.40
RAD52 P43351 3/20 0.40
LMNA P02545 2/20 0.40
RGS12 O14924 1/20 0.40
USP2 O75604 1/20 0.40
HSP90AA1 P07900 1/20 0.40
THRB P10828 1/20 0.40
MCL1 Q07820 1/20 0.40
POLB P06746 1/20 0.39
KDM4A O75164 2/20 0.37
KDM2A Q9Y2K7 2/20 0.37

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
SCHEMBL18035808 0.98 NPC1 (0.41) SMN1; SMN2NPC1RAB9AKDM4EMEN1
SCHEMBL16115237 0.94 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AKDM4EMEN1
Acetic Acid SCHEMBL15210171 0.89 NPC1 (0.35) SMN1; SMN2NPC1RAB9AKDM4EMEN1
Hydrochloric Acid SCHEMBL30330888 0.81 SMN1; SMN2 (0.45) SMN1; SMN2NPC1RAB9AKDM4EMEN1
Hydrochloric Acid SCHEMBL9327469 0.81 SMN1; SMN2 (0.45) SMN1; SMN2NPC1RAB9AKDM4EMEN1
Hydrochloric Acid SCHEMBL29251700 0.80 SMN1; SMN2 (0.44) SMN1; SMN2NPC1RAB9AKDM4EMEN1
SCHEMBL329217 0.79 NPC1 (0.46) SMN1; SMN2NPC1RAB9AKDM4EMEN1
SCHEMBL29561039 0.79 NPC1 (0.46) SMN1; SMN2NPC1RAB9AKDM4EMEN1
SCHEMBL12558270 0.78 NPC1 (0.45) SMN1; SMN2NPC1RAB9AKDM4EMEN1
SCHEMBL28139801 0.78 NPC1 (0.45) SMN1; SMN2NPC1RAB9AKDM4EMEN1

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-2638123-B1 WORKING MEDIUM FOR ABSORPTION HEAT PUMPS EVONIK DEGUSSA GMBH (DE) 2016-08-31 EP claimed
US-20130219949-A1 WORKING MEDIUM FOR ABSORPTION HEAT PUMPS EVONIK DEGUSSA GMBH (DE) 2013-08-29 US claimed
US-20130219949-A1 WORKING MEDIUM FOR ABSORPTION HEAT PUMPS EVONIK DEGUSSA GMBH (DE) 2013-08-29 US disclosed
CN-1830928-B Process for the preparation of alkyl chlorides EVONIK DEGUSSA GMBH 2010-12-08 CN disclosed
US-7652180-B2 Process for preparing alkyl chlorides DEGUSSA AG (DE) 2010-01-26 US disclosed
US-20060205987-A1 Process for preparing alkyl chlorides DEGUSSA AG (DE) 2006-09-14 US disclosed
CN-1830928-A Process for the preparation of alkyl chlorides DEGUSSA (DE) 2006-09-13 CN 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-20060205987-A1 Process for preparing alkyl chlorides HACL2, ARL1, MGLL ACHE 3436/4885SMN1; SMN2 4464/4885NPC1 3161/4885

“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.