SCHEMBL4728579

SCHEMBL4728579

CCC(C(=O)O)c1ccc(CC=NOCc2nc(-c3ccc(C)cc3)oc2C)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.47
PPARA Q07869 16/20 0.45
PPARD Q03181 1/20 0.43
KDM4E B2RXH2 1/20 0.41
RAB9A P51151 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL4726338 0.85 PPARG (0.49) PPARGPPARAPPARDKDM4ERAB9A
SCHEMBL4728577 0.81 PPARG (0.61) PPARGPPARAPPARDPOLB
SCHEMBL4731241 0.81 PPARG (0.49) PPARGPPARAPPARDPOLB
SCHEMBL4728610 0.77 PPARA (0.49) PPARGPPARAPPARDPOLB
SCHEMBL4726357 0.77 PPARG (0.67) PPARGPPARAPPARD
SCHEMBL4730644 0.75 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL4726349 0.74 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL4969862 0.73 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL4969855 0.73 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL4728902 0.73 PPARA (0.55) PPARGPPARAPPARDPOLB

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