SCHEMBL8941658

SCHEMBL8941658

CCCCCCCCCCCC(C)C(=S)COS(=O)(=O)c1c(C(C)C)cc(C(C)C)cc1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
ENPP3 O14638 2/20 0.35
ENPP1 P22413 2/20 0.35
SOAT1 P35610 1/20 0.33

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
SCHEMBL9059244 0.81 FABP3 (0.40) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL8941659 0.77 SOAT1 (0.35) FABP3FABP4FABP5SOAT1
SCHEMBL11888501 0.72 FABP4 (0.55) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL17639907 0.67 FABP4 (0.57) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL15082948 0.66 FABP4 (0.51) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL592480 0.66 FABP3 (0.64) FABP3FABP4FABP5
Tetrabuthylammonium SCHEMBL592617 0.65 FABP4 (0.68) FABP3FABP4FABP5
SCHEMBL2946584 0.65 FABP4 (0.62) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL11889235 0.65 FABP4 (0.62) FABP3FABP4FABP5
SCHEMBL20464065 0.65 FABP4 (0.49) FABP3FABP4FABP5ENPP3ENPP1

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-5510379-A USEFUL FOR TREATING HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1996-04-23 US disclosed