SCHEMBL4728589

SCHEMBL4728589

CC(=NOCc1nc(-c2ccccc2)oc1C)c1ccc(OCC(=O)O)c(C)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 1.00
PPARA Q07869 14/20 1.00
PPARD Q03181 4/20 1.00
FFAR1 O14842 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.44

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
SCHEMBL4726309 1.00 PPARG (1.00) PPARGPPARAPPARDFFAR1KDM4E
SCHEMBL18644987 1.00 PPARG (1.00) PPARGPPARAPPARDFFAR1KDM4E
SCHEMBL4726352 0.94 PPARG (1.00) PPARGPPARAPPARDMAPT
SCHEMBL4731275 0.86 PPARG (0.79) PPARGPPARAPPARDFFAR1MAPT
SCHEMBL4731269 0.86 PPARG (0.79) PPARGPPARAPPARDFFAR1MAPT
SCHEMBL4729096 0.84 PPARD (0.73) PPARGPPARAPPARDKDM4E
SCHEMBL4728564 0.84 PPARG (0.72) PPARGPPARAPPARD
SCHEMBL4728569 0.84 PPARG (0.72) PPARGPPARAPPARD
SCHEMBL4899515 0.84 PPARG (0.76) PPARGPPARAPPARDMAPT
SCHEMBL4729536 0.84 PPARG (0.76) PPARGPPARAPPARDMAPT

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 1 patent. 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