SCHEMBL8024565

SCHEMBL8024565

CC[C@H](NC(=O)c1ccc2c(c1)nc(C)n2Cc1ccc(Cl)c(Cl)c1)c1ccc(C)cc1

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.87
AGTR1 P30556 1/20 0.53

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
SCHEMBL8045639 0.93 PPARG (1.00) PPARG
SCHEMBL8035491 0.93 PPARG (1.00) PPARG
SCHEMBL4564570 0.93 PPARG (1.00) PPARG
SCHEMBL8037669 0.89 PPARG (0.85) PPARGAGTR1
SCHEMBL8039981 0.87 PPARG (0.83) PPARGAGTR1
SCHEMBL8032219 0.87 PPARG (0.77) PPARG
SCHEMBL4565524 0.85 PPARG (0.77) PPARG
SCHEMBL8042319 0.85 PPARG (0.79) PPARGAGTR1
SCHEMBL8038773 0.84 PPARG (0.73) PPARG
SCHEMBL4561075 0.84 PPARG (0.76) 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