SCHEMBL6532082

SCHEMBL6532082

CN(CC#Cc1ccc(CC2SC(=O)NC2=O)cc1)c1nc2ccccc2o1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.49
FFAR1 O14842 6/20 0.43
PPARA Q07869 4/20 0.43
RARG P13631 1/20 0.42
RXRA P19793 1/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL6506244 0.85 PTPN1 (0.46) PPARGFFAR1PPARA
Brl-48482 SCHEMBL1850299 0.82 PPARG (0.68) PPARGFFAR1PPARARARGRXRA
SCHEMBL6511223 0.81 PPARG (0.70) PPARGFFAR1PPARARARGRXRA
Brl-48482 SCHEMBL6806392 0.81 PPARG (0.67) PPARGFFAR1PPARARARGRXRA
SCHEMBL1848402 0.81 PPARG (0.62) PPARGFFAR1PPARARARGRXRA
SCHEMBL1847319 0.81 PPARG (0.61) PPARGFFAR1PPARARARGRXRA
SCHEMBL9803874 0.80 PPARG (0.51) PPARGFFAR1PPARARARGRXRA
SCHEMBL6506413 0.76 PPARG (0.47) PPARG
SCHEMBL6506410 0.76 PPARG (0.47) PPARG
SCHEMBL2177881 0.75 PPARG (0.70) PPARGFFAR1PPARARARGRXRA

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-2005100331-A2 ANTIDIABETIC AGENTS RANBAXY LABORATORIES LIMITED (IN) 2005-10-27 WO disclosed