SCHEMBL6073250

SCHEMBL6073250

Cc1cccc(OC(=O)N(CC(=O)O)Cc2cccc(OCCN(C)c3nc4ccccc4o3)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.53
PPARG P37231 18/20 0.51
PPARD Q03181 6/20 0.49
CYP2C9 P11712 1/20 0.49
KCNH2 Q12809 1/20 0.49

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
SCHEMBL6073212 0.94 PPARA (0.57) PPARAPPARGPPARDCYP2C9KCNH2
SCHEMBL6073122 0.94 PPARG (0.58) PPARAPPARGPPARDCYP2C9KCNH2
SCHEMBL6073846 0.92 PPARG (0.51) PPARAPPARGPPARD
SCHEMBL6073153 0.91 PPARA (0.53) PPARAPPARGPPARDCYP2C9KCNH2
SCHEMBL6073091 0.91 PPARG (0.56) PPARAPPARGPPARDCYP2C9KCNH2
SCHEMBL6073052 0.90 PPARG (0.55) PPARAPPARGPPARDCYP2C9KCNH2
SCHEMBL6073186 0.90 PPARG (0.58) PPARAPPARGCYP2C9KCNH2
SCHEMBL6073437 0.89 PPARG (0.52) PPARAPPARGPPARDCYP2C9KCNH2
SCHEMBL6073226 0.88 PPARG (0.54) PPARAPPARGPPARD
SCHEMBL6073248 0.88 PPARA (0.56) PPARAPPARGPPARD

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-2006117743-A1 SUBSTITUTED AROMATIC COMPOUNDS AS ANTIDIABETIC AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO disclosed