Salicylic Acid

Salicylic Acid

SCHEMBL7620792

CCNCC.CCO.O=C(O)c1ccccc1O

nearest known ligand 0.64

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Known targets — ChEMBL curated mechanism

ACHE

The experimentally established mechanism targets of Salicylic 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
KDM4E B2RXH2 9/20 0.64
ALDH1A1 P00352 6/20 0.64
HPGD P15428 5/20 0.64
CA9 Q16790 3/20 0.64
CA1 P00915 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
CA12 O43570 2/20 0.64
CA2 P00918 1/20 0.64
HMGB1 P09429 1/20 0.64
CA4 P22748 1/20 0.64
CA6 P23280 1/20 0.64
CA7 P43166 1/20 0.64
NAPRT Q6XQN6 1/20 0.64
CA14 Q9ULX7 1/20 0.64
HSD17B10 Q99714 4/20 0.49
LMNA P02545 5/20 0.47
TSHR P16473 2/20 0.47
HTT P42858 2/20 0.45
MAPT P10636 2/20 0.45
ALOX15 P16050 1/20 0.45

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
Salicylic Acid SCHEMBL1070298 0.96 KDM4E (0.69) KDM4EALDH1A1HPGDCA9CA1
Salicylic Acid SCHEMBL31332109 0.91 ALDH1A1 (0.78) KDM4EALDH1A1HPGDCA9CA1
Salicylic Acid SCHEMBL25288775 0.91 ALDH1A1 (0.78) KDM4EALDH1A1HPGDCA9CA1
Salicylic Acid SCHEMBL27732770 0.89 ALDH1A1 (0.75) KDM4EALDH1A1HPGDCA9CA1
Salicylic Acid SCHEMBL982280 0.89 ALDH1A1 (0.75) KDM4EALDH1A1HPGDCA9CA1
Salicylic Acid SCHEMBL30297915 0.89 ALDH1A1 (0.75) KDM4EALDH1A1HPGDCA9CA1
Salicylic Acid SCHEMBL30297957 0.89 ALDH1A1 (0.75) KDM4EALDH1A1HPGDCA9CA1
Salicylic Acid SCHEMBL28175461 0.87 ALDH1A1 (0.72) KDM4EALDH1A1HPGDCA9CA1
Diethylamine SCHEMBL3323938 0.86 ALDH1A1 (0.55) KDM4EALDH1A1HPGDCA9CA1
Phthalic Acid SCHEMBL4372897 0.85 ALDH1A1 (0.64) KDM4EALDH1A1HPGDCA9CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0926952-B1 AN ANTIMICROBIAL COMPOSITION, A METHOD FOR THE PREPARATION OF SAME KEMIRA CHEMICALS OY (FI) 2002-04-03 EP disclosed
EP-0926952-A1 AN ANTIMICROBIAL COMPOSITION, A METHOD FOR THE PREPARATION OF SAME KEMIRA CHEMICALS OY (FI) 1999-07-07 EP disclosed
WO-1998003066-A1 AN ANTIMICROBIAL COMPOSITION, A METHOD FOR THE PREPARATION OF SAME KEMIRA CHEMICALS OY (FI) 1998-01-29 WO disclosed