Salicylic Acid

Salicylic Acid

SCHEMBL1835748

COC(C)NC(C)OC.O=C(O)c1ccccc1O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

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
HPGD P15428 9/20 0.60
KDM4E B2RXH2 8/20 0.60
ALDH1A1 P00352 7/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
HMGB1 P09429 1/20 0.60
CA4 P22748 1/20 0.60
CA6 P23280 1/20 0.60
CA7 P43166 1/20 0.60
CA9 Q16790 1/20 0.60
NAPRT Q6XQN6 1/20 0.60
CA14 Q9ULX7 1/20 0.60
LMNA P02545 6/20 0.53
TSHR P16473 3/20 0.53
HSD17B10 Q99714 7/20 0.47
ALOX15 P16050 3/20 0.42
MEN1 O00255 2/20 0.42
HTT P42858 2/20 0.42

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 SCHEMBL27732823 0.83 HPGD (0.64) HPGDKDM4EALDH1A1SMN1; SMN2CA12
Salicylic Acid SCHEMBL28963054 0.82 KDM4E (0.69) HPGDKDM4EALDH1A1SMN1; SMN2CA12
SCHEMBL2533420 0.82 ALDH1A1 (0.61) HPGDKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL1834432 0.82 POLB (0.47) HPGDKDM4EALDH1A1SMN1; SMN2HSD17B10
Salicylic Acid SCHEMBL27675724 0.82 HPGD (0.82) HPGDKDM4EALDH1A1SMN1; SMN2CA12
SCHEMBL1838103 0.81 KDM4E (0.45) HPGDKDM4EALDH1A1CA12CA1
SCHEMBL1838097 0.81 KDM4E (0.45) HPGDKDM4EALDH1A1CA12CA1
Salicylic Acid SCHEMBL1835141 0.81 HPGD (0.67) HPGDKDM4EALDH1A1SMN1; SMN2CA12
Salicylic Acid SCHEMBL15568422 0.80 ALDH1A1 (0.78) HPGDKDM4EALDH1A1SMN1; SMN2CA12
Salicylic Acid SCHEMBL27871001 0.80 ALDH1A1 (0.78) HPGDKDM4EALDH1A1SMN1; 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US claimed
US-9328220-B2 Liquids INNOVIA FILMS LIMITED (GB) 2016-05-03 US disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 EP disclosed
US-20080221361-A1 Ionic Liquids BIONIQS LIMITED (GB) 2008-09-11 US disclosed
EP-1948589-A1 IONIC LIQUIDS Bioniqs Limited (GB) 2008-07-30 EP disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US disclosed
WO-2007036712-A1 IONIC LIQUIDS BIONIQS LIMITED (GB) 2007-04-05 WO disclosed