SCHEMBL9059244

SCHEMBL9059244

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

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
ENPP3 O14638 2/20 0.36
ENPP1 P22413 2/20 0.36

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
SCHEMBL8941658 0.81 FABP3 (0.40) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL11888501 0.71 FABP4 (0.55) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL17639907 0.67 FABP4 (0.57) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL16382407 0.66 FABP4 (0.45) FABP3FABP4FABP5ENPP3ENPP1
SCHEMBL8941378 0.66 SMN1; SMN2 (0.50) ENPP3ENPP1
SCHEMBL592480 0.65 FABP3 (0.64) FABP3FABP4FABP5
SCHEMBL9059246 0.65 RXRA (0.32) FABP3FABP4FABP5
Tetrabuthylammonium SCHEMBL592617 0.65 FABP4 (0.68) FABP3FABP4FABP5
SCHEMBL7956331 0.65 FFAR1 (0.46)
SCHEMBL3174984 0.65 ACE2 (0.46)

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
WO-1996019444-A1 SULFONATE ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1996-06-27 WO disclosed