SCHEMBL4728567

SCHEMBL4728567

Cc1cc(CCCC=NOCc2ccc(C(F)(F)F)cc2)ccc1OCC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 17/20 0.53
PPARA Q07869 5/20 0.53
PPARG P37231 3/20 0.53
FFAR4 Q5NUL3 3/20 0.48
FFAR1 O14842 1/20 0.48
FFAR2 O15552 1/20 0.48

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
SCHEMBL4727949 0.88 PPARD (0.59) PPARDPPARAPPARG
SCHEMBL4726367 0.83 PPARA (0.46) PPARDPPARAPPARGFFAR4FFAR1
SCHEMBL12476656 0.82 MAPT (0.40) PPARDPPARAPPARGFFAR4FFAR1
SCHEMBL4728588 0.78 PPARD (0.73) PPARDPPARAPPARG
SCHEMBL4727946 0.78 PPARD (0.73) PPARDPPARAPPARG
SCHEMBL13513908 0.78 PPARD (0.67) PPARDPPARAPPARGFFAR4
SCHEMBL5512645 0.78 PPARD (0.72) PPARDPPARAPPARG
SCHEMBL4730148 0.78 PPARD (0.56) PPARDPPARAPPARG
SCHEMBL4730229 0.77 PPARD (0.57) PPARDPPARAPPARG
SCHEMBL4729104 0.77 PPARD (0.52) PPARDPPARAPPARGFFAR4FFAR1

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