SCHEMBL11760874

SCHEMBL11760874

CC1CCC=C(C(C)C)C1.Cc1ccc(C(C)C)c(O)c1S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.32
FABP4 P15090 1/20 0.32
FABP5 Q01469 1/20 0.32

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
SCHEMBL8926663 0.79 FABP3 (0.47) FABP3FABP4FABP5
Potassium Ion SCHEMBL18247779 0.68 LMNA (0.41) FABP3FABP4FABP5
Phenolsulphonic Acid SCHEMBL11765506 0.68 PKLR (0.36)
SCHEMBL30858733 0.68 FABP3 (0.47) FABP3FABP4FABP5
SCHEMBL26028062 0.66 FABP3 (0.48) FABP3FABP4FABP5
SCHEMBL11627738 0.65 ACHE (0.44)
SCHEMBL8370447 0.64 TYR (0.44) FABP3FABP4FABP5
SCHEMBL1808650 0.63 ALDH1A1 (0.40) FABP3FABP4FABP5
SCHEMBL8367579 0.62 TYR (0.42) FABP3FABP4FABP5
SCHEMBL12018139 0.62 FABP3 (0.47) FABP3FABP4FABP5

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-4054669-A ANTI-INFLUENZA, ANTI GRAMPOSITIVE BACTERIA LES DERIVES RESINIQUES ET TERPENIQUES (FR) 1977-10-18 US disclosed