SCHEMBL8035404

SCHEMBL8035404

COc1ccc(C(C)NC(=O)c2ccc3c(c2)nc(C)n3Cc2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.81
DCTPP1 Q9H773 1/20 0.54
TAS1R3 Q7RTX0 1/20 0.52
TAS1R1 Q7RTX1 1/20 0.52
HTT P42858 1/20 0.51

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
SCHEMBL8037681 0.89 PPARG (1.00) PPARG
SCHEMBL8035508 0.89 PPARG (1.00) PPARG
SCHEMBL8022871 0.88 PPARG (0.64) PPARG
SCHEMBL8024565 0.81 PPARG (0.87) PPARG
SCHEMBL4532827 0.80 PPARG (0.68) PPARGDCTPP1HTT
SCHEMBL16731561 0.80 PPARG (0.72) PPARG
SCHEMBL15992298 0.79 PPARG (0.62) PPARG
SCHEMBL15992300 0.79 PPARG (0.62) PPARG
SCHEMBL4564570 0.79 PPARG (1.00) PPARG
SCHEMBL8035491 0.79 PPARG (1.00) PPARG

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-2009083526-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-07-09 WO disclosed