Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4875000

CC(C)Nc1ccc2nc(CCC(=O)O)sc2n1.[Cl-].[H+]

nearest known ligand 0.44

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
HDAC6 Q9UBN7 2/20 0.44
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 2/20 0.35
MAPT P10636 2/20 0.35
RECQL P46063 1/20 0.35
HCAR3 P49019 1/20 0.35
HPGD P15428 3/20 0.34
RAB9A P51151 1/20 0.34
GAA P10253 1/20 0.34
GCG P01275 2/20 0.34
MAOB P27338 1/20 0.33
USP28 Q96RU2 1/20 0.33
USP25 Q9UHP3 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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 SCHEMBL4875007 0.96 HDAC6 (0.45) HDAC6ALOX15HTTSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4673069 0.86 MAOB (0.47) HDAC6ALOX15HTTSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4673072 0.82 MAOB (0.48) HDAC6ALOX15HTTSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4873994 0.76 HDAC6 (0.44) HDAC6ALOX15HTTSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4669334 0.73 MAOB (0.50) HDAC6ALOX15HTTSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4870515 0.72 MAOB (0.51) HDAC6ALOX15HTTSMN1; SMN2POLB
SCHEMBL4929694 0.71 HDAC6 (0.53) HDAC6ALOX15HTTSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4669337 0.69 MAOB (0.51) HDAC6ALOX15HTTSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4875252 0.69 HDAC6 (0.42) HDAC6HTTMAPTRECQLHPGD
SCHEMBL544264 0.68 MAOB (0.39) HCAR3MAOBIRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287434-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands SANOFI-AVENTIS (FR) 2008-11-20 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-20080287434-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands CCR3, CCR1, CCR4 HDAC6 782/4885ALOX15 3100/4885HTT 4829/4885

“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.