Salicylic Acid

Salicylic Acid

SCHEMBL9813624

CC1CC(C)(C)NC(C)(C)C1.O=C(O)c1ccccc1O

nearest known ligand 0.55

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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 6/20 0.55
KDM4E B2RXH2 5/20 0.55
HPGD P15428 4/20 0.55
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
HMGB1 P09429 1/20 0.55
CA4 P22748 1/20 0.55
CA6 P23280 1/20 0.55
CA7 P43166 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
CA9 Q16790 1/20 0.55
NAPRT Q6XQN6 1/20 0.55
CA14 Q9ULX7 1/20 0.55
ALOX15 P16050 1/20 0.52
LMNA P02545 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
Methyl Salicylate SCHEMBL9813841 0.84 TSHR (0.61) ALDH1A1KDM4EHPGDCA12CA1
Naphthoic Acid SCHEMBL9813601 0.81 KMT2A (0.62) ALDH1A1KDM4EHPGDSMN1; SMN2ALOX15
Benzoic Acid SCHEMBL9813692 0.81 GAA (0.58) KDM4ENAPRTALOX15GAAKMT2A
Pyromellitic Acid SCHEMBL10684063 0.80 ALOX15 (0.46) KDM4EALOX15GAAKMT2APOLB
Pyromellitic Acid SCHEMBL9813658 0.80 ALOX15 (0.46) KDM4EALOX15GAAKMT2APOLB
SCHEMBL9813709 0.78 ALOX15 (0.46) ALDH1A1KDM4EHPGDALOX15CYP3A4
Phthalic Acid SCHEMBL11485468 0.78 ALOX15 (0.61) ALDH1A1KDM4EALOX15LMNACYP3A4
Salicylic Acid SCHEMBL3397874 0.77 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDCA12CA1
Salicylic Acid SCHEMBL6640057 0.76 ALDH1A1 (0.95) ALDH1A1KDM4EHPGDCA12CA1
Salicylic Acid SCHEMBL30554634 0.76 ALDH1A1 (0.95) ALDH1A1KDM4EHPGDCA12CA1

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-0163245-B1 DERIVATIVES OF ALKYL-SUBSTITUTED 4-HYDROXY-METHYL-PIPERIDINE AND USE THEREOF AS STABILIZERS AUSIMONT S.r.l. (IT) 1991-07-31 EP disclosed
US-4772708-A STABILIZERS FOR POLYMERS AUSIMONT S.P.A. (IT) 1988-09-20 US disclosed
EP-0163245-A2 Derivatives of alkyl-substituted 4-hydroxy-methyl-piperidine and use thereof as stabilizers AUSIMONT S.r.l. (IT) 1985-12-04 EP disclosed