Salicylic Acid

Salicylic Acid

SCHEMBL9800701

CS(=O)(=O)O.O=C(O)c1ccccc1O

nearest known ligand 0.75

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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 10/20 0.75
ALDH1A1 P00352 8/20 0.75
HPGD P15428 7/20 0.75
SMN1; SMN2 Q16637 2/20 0.75
CA1 P00915 2/20 0.75
CA2 P00918 2/20 0.75
CA12 O43570 1/20 0.75
HMGB1 P09429 1/20 0.75
CA4 P22748 1/20 0.75
CA6 P23280 1/20 0.75
CA7 P43166 1/20 0.75
CA9 Q16790 1/20 0.75
NAPRT Q6XQN6 1/20 0.75
CA14 Q9ULX7 1/20 0.75
LMNA P02545 4/20 0.53
TSHR P16473 2/20 0.53
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 5/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50

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 SCHEMBL4295686 0.91 KDM4E (0.82) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Salicylic Acid SCHEMBL31490109 0.91 KDM4E (0.82) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Salicylic Acid SCHEMBL28820609 0.89 KDM4E (0.78) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Salicylic Acid SCHEMBL8176134 0.89 KDM4E (0.78) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Salicylic Acid SCHEMBL9228055 0.88 KDM4E (0.75) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Salicylic Acid SCHEMBL6725453 0.88 KDM4E (0.75) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Salicylic Acid SCHEMBL30940555 0.88 KDM4E (0.75) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Salicylic Acid SCHEMBL11514985 0.88 KDM4E (0.75) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Salicylic Acid SCHEMBL3409946 0.87 ALDH1A1 (0.82) KDM4EALDH1A1HPGDSMN1; SMN2CA1
Phthalic Acid SCHEMBL28283849 0.87 ALDH1A1 (0.70) KDM4EALDH1A1HPGDSMN1; SMN2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5015648-A 7-(((1,1*-biphenyl)4-yl)-3-hydroxy-2-(1-piperidinyl) cyclopenty l)-4-hepteoic acid or cyclodextran derivative GLAXO GROUP LIMITED (GB) 1991-05-14 US disclosed
EP-0335627-A2 Use of a thromboxane antagonist in cyclosporin A-induced nephrotoxicity GLAXO GROUP LIMITED (GB) 1989-10-04 EP disclosed