Salicylic Acid

Salicylic Acid

SCHEMBL10385490

O=C(O)c1ccccc1O.[BaH2].[Ti]

nearest known ligand 0.90

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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
ALDH1A1 P00352 7/20 0.90
KDM4E B2RXH2 7/20 0.90
HPGD P15428 7/20 0.90
SMN1; SMN2 Q16637 3/20 0.90
CA12 O43570 1/20 0.90
CA1 P00915 1/20 0.90
CA2 P00918 1/20 0.90
HMGB1 P09429 1/20 0.90
CA4 P22748 1/20 0.90
CA6 P23280 1/20 0.90
CA7 P43166 1/20 0.90
CA9 Q16790 1/20 0.90
NAPRT Q6XQN6 1/20 0.90
CA14 Q9ULX7 1/20 0.90
ALOX15 P16050 2/20 0.62
HSD17B10 Q99714 4/20 0.57
MAPT P10636 4/20 0.56
TSHR P16473 2/20 0.56
G6PD P11413 1/20 0.56
CASP7 P55210 1/20 0.56

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 SCHEMBL162517 0.97 ALDH1A1 (0.95) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL31665922 0.97 ALDH1A1 (0.95) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL28028722 0.97 ALDH1A1 (0.95) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL299754 0.97 ALDH1A1 (0.95) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL11384816 0.95 ALDH1A1 (0.90) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL29362663 0.95 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL1967 0.95 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL29360246 0.95 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL8433746 0.95 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2CA12
Salicylic Acid SCHEMBL29606432 0.95 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2CA12

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-4966742-A ROASTING COORDINATION COMPLEX KHOURY ISSAM A (US) 1990-10-30 US disclosed