SCHEMBL6506592

SCHEMBL6506592

COC(=O)C(Cc1ccc(OCCBr)cc1)/C(C)=N/OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.52
PPARA Q07869 12/20 0.52
PPARD Q03181 4/20 0.52
LTA4H P09960 1/20 0.47
ITGB3 P05106 2/20 0.43
ITGA2B P08514 2/20 0.43

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
SCHEMBL6506595 1.00 PPARG (0.52) PPARGPPARAPPARDLTA4HITGB3
SCHEMBL6504116 0.84 MIF (0.50) PPARGPPARAPPARDLTA4H
SCHEMBL6504111 0.84 MIF (0.50) PPARGPPARAPPARDLTA4H
SCHEMBL6503040 0.78 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL6503037 0.78 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL6532483 0.77 PPARG (0.43) PPARGPPARAPPARDLTA4H
SCHEMBL6532478 0.77 PPARG (0.43) PPARGPPARAPPARDLTA4H
SCHEMBL7033327 0.76 PPARG (0.67) PPARGPPARAPPARDLTA4HITGB3
SCHEMBL6510502 0.76 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL6510499 0.76 PPARG (0.50) PPARGPPARAPPARD

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-2005040127-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2005-05-06 WO disclosed