SCHEMBL4728902

SCHEMBL4728902

Cc1ccc(-c2nc(CON=CCCc3ccc(OCC(=O)O)cc3)c(C)o2)cc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 15/20 0.55
PPARG P37231 13/20 0.55
FFAR1 O14842 1/20 0.55
PPARD Q03181 1/20 0.53
MAPT P10636 2/20 0.49
POLB P06746 1/20 0.47

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
SCHEMBL4796629 0.94 PPARG (0.64) PPARAPPARGFFAR1PPARD
SCHEMBL4728610 0.84 PPARA (0.49) PPARAPPARGFFAR1PPARDMAPT
SCHEMBL4729706 0.83 PPARG (0.45) PPARAPPARGFFAR1PPARD
SCHEMBL4727548 0.83 PPARG (0.66) PPARAPPARGFFAR1PPARD
SCHEMBL4728895 0.81 PPARG (0.61) PPARAPPARGFFAR1PPARDPOLB
SCHEMBL15543187 0.81 FFAR1 (0.52) PPARAPPARGFFAR1POLB
SCHEMBL4726357 0.80 PPARG (0.67) PPARAPPARGFFAR1PPARD
SCHEMBL12476895 0.79 FFAR1 (0.50) PPARAPPARGFFAR1MAPT
SCHEMBL4726338 0.79 PPARG (0.49) PPARAPPARGFFAR1PPARDMAPT
SCHEMBL4730624 0.78 PPARD (0.44) PPARAFFAR1PPARDPOLB

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
WO-2008035359-A2 OXIMINOPHENOXYALKANOIC ACID AND PHENYLALKANOIC ACID DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2008-03-27 WO claimed
WO-2008035359-A2 OXIMINOPHENOXYALKANOIC ACID AND PHENYLALKANOIC ACID DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2008-03-27 WO disclosed