SCHEMBL4554891

SCHEMBL4554891

CC(C)(C)C1c2ccc(NC(=O)c3nnc(COc4ccccc4Cl)s3)cc2CCN1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.44

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
SCHEMBL4554892 0.87 FFAR1 (0.43) FFAR1
SCHEMBL4555437 0.85 FFAR1 (0.38) FFAR1
SCHEMBL4555464 0.85 LMNA (0.47)
SCHEMBL4553185 0.83 FFAR1 (0.45) FFAR1
SCHEMBL4554910 0.81 HPGD (0.35)
SCHEMBL3728409 0.79 ESR2 (0.48) FFAR1
SCHEMBL3725212 0.75 FFAR1 (0.46) FFAR1
Hydrochloric Acid SCHEMBL3725783 0.74 FFAR1 (0.45) FFAR1
SCHEMBL4555465 0.73 LMNA (0.44)
SCHEMBL4555617 0.72 ALDH1A1 (0.41)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125799-A1 THIADIAZOLE DERIVATIVES, INHIBITORS OF STEAROYL-COA DESATURASE Smithkline Beecham Corporation (US) 2009-12-02 EP disclosed
WO-2008104524-A1 THIADIAZOLE DERIVATIVES, INHIBITORS OF STEAROYL-COA DESATURASE SMITHKLINE BEECHAM CORPORATION (US) 2008-09-04 WO disclosed