Salicylic Acid

Salicylic Acid

SCHEMBL9541012

CN1c2ccc(O)cc2C2(C)CCN(CC3CC3)C12.O=C(O)c1ccccc1O

nearest known ligand 0.55

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
ACHE known ✓ P22303 4/20 0.55
KDM4E B2RXH2 5/20 0.55
BCHE P06276 4/20 0.55
ALDH1A1 P00352 3/20 0.55
HPGD P15428 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HIF1A Q16665 2/20 0.55
HSD17B10 Q99714 2/20 0.55
MAPT P10636 2/20 0.52
G6PD P11413 1/20 0.52
GMNN O75496 1/20 0.52
LMNA P02545 1/20 0.52
THRB P10828 1/20 0.52
BLM P54132 1/20 0.52
PMP22 Q01453 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TP53 P04637 2/20 0.52
ALOX15 P16050 2/20 0.52
CYP2D6 P10635 2/20 0.52
MTOR P42345 1/20 0.52

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
SCHEMBL9538917 0.87 KDM4E (0.67) KDM4EALDH1A1SMN1; SMN2HIF1AHSD17B10
SCHEMBL8827823 0.87 KDM4E (0.67) KDM4EALDH1A1SMN1; SMN2HIF1AHSD17B10
SCHEMBL8827828 0.87 KDM4E (0.67) KDM4EALDH1A1SMN1; SMN2HIF1AHSD17B10
Salicylic Acid SCHEMBL9538396 0.87 BCHE (0.61) KDM4EBCHEACHEALDH1A1HPGD
Salicylic Acid SCHEMBL9539721 0.86 BCHE (0.57) KDM4EBCHEACHEALDH1A1HPGD
Salicylic Acid SCHEMBL8827810 0.85 KDM4E (0.72) KDM4EBCHEACHEALDH1A1HPGD
Salicylic Acid SCHEMBL9541177 0.85 BCHE (0.43) KDM4EBCHEACHEALDH1A1HPGD
SCHEMBL9541017 0.84 ACHE (0.58) KDM4EBCHEACHEALDH1A1HPGD
SCHEMBL8827805 0.76 BCHE (0.66) KDM4EBCHEACHEHIF1AHSD17B10
SCHEMBL8827803 0.76 BCHE (0.66) KDM4EBCHEACHEHIF1AHSD17B10

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-5187165-A Eseroline derivatives; cholinergic agents; antidepressants HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-02-16 US disclosed