SCHEMBL4731241

SCHEMBL4731241

CCC(Oc1ccc(CC=NOCc2nc(-c3ccc(C)cc3)oc2C)cc1C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.49
PPARA Q07869 15/20 0.49
PPARD Q03181 4/20 0.49
POLB P06746 1/20 0.40
TP53 P04637 1/20 0.40
KMT2A Q03164 1/20 0.39

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
SCHEMBL4730644 0.94 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL4726349 0.91 PPARG (0.48) PPARGPPARAPPARDTP53KMT2A
SCHEMBL4726343 0.85 PPARG (0.53) PPARGPPARAPPARDPOLBTP53
SCHEMBL4726243 0.85 PPARA (0.38) PPARGPPARAPPARD
SCHEMBL4726357 0.85 PPARG (0.67) PPARGPPARAPPARDTP53KMT2A
SCHEMBL4727900 0.83 PPARG (0.53) PPARGPPARAPPARDPOLB
SCHEMBL4731237 0.82 PPARG (0.73) PPARGPPARAPPARDPOLBTP53
SCHEMBL4728610 0.82 PPARA (0.49) PPARGPPARAPPARDPOLB
SCHEMBL4728579 0.81 PPARG (0.47) PPARGPPARAPPARDPOLB
SCHEMBL4728138 0.80 PPARG (0.58) PPARGPPARAPPARDPOLBTP53

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