SCHEMBL4729101

SCHEMBL4729101

Cc1cc(CC=NOCc2nc(C(C)(C)C)oc2C)ccc1OCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 16/20 0.47
PPARA Q07869 9/20 0.47
PPARG P37231 8/20 0.47
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36

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
SCHEMBL4726310 0.85 PPARG (0.67) PPARDPPARAPPARGFFAR1
SCHEMBL4726243 0.84 PPARA (0.38) PPARDPPARAPPARG
SCHEMBL4726357 0.84 PPARG (0.67) PPARDPPARAPPARGFFAR1
SCHEMBL4729706 0.80 PPARG (0.45) PPARDPPARAPPARGFFAR1
SCHEMBL4729096 0.80 PPARD (0.73) PPARDPPARAPPARG
SCHEMBL4727949 0.76 PPARD (0.59) PPARDPPARAPPARG
SCHEMBL4726950 0.75 LTB4R (0.44) PPARDPPARAPPARGFFAR1FFAR4
SCHEMBL4784365 0.74 CDK8 (0.38) PPARDPPARAPPARG
SCHEMBL4727548 0.74 PPARG (0.66) PPARDPPARAPPARGFFAR1
SCHEMBL4729537 0.71 PPARD (0.72) PPARDPPARAPPARGFFAR1

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