SCHEMBL6704879

SCHEMBL6704879

COC(=O)C(Cc1ccc(OCCOc2ccc(CC(C(=O)O)C(=O)O)cc2)cc1)C(=O)OC

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.71
PPARD Q03181 10/20 0.71
PPARA Q07869 8/20 0.71
LDHA P00338 1/20 0.63
PTPRB P23467 1/20 0.51
LTA4H P09960 1/20 0.48

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
SCHEMBL6696075 0.95 PPARG (0.66) PPARGPPARDPPARALDHAPTPRB
SCHEMBL28512690 0.88 PPARG (0.67) PPARGPPARDPPARAPTPRB
SCHEMBL6382746 0.88 PPARG (0.67) PPARGPPARDPPARALDHAPTPRB
SCHEMBL20395690 0.88 PPARG (0.67) PPARGPPARDPPARALDHAPTPRB
SCHEMBL6688424 0.87 LDHA (0.58) PPARGPPARDPPARALDHAPTPRB
SCHEMBL6688428 0.87 LDHA (0.58) PPARGPPARDPPARALDHAPTPRB
SCHEMBL6484840 0.86 PPARG (0.65) PPARGPPARDPPARALDHAPTPRB
SCHEMBL7033327 0.85 PPARG (0.67) PPARGPPARDPPARALTA4H
SCHEMBL20395698 0.84 PPARG (0.62) PPARGPPARDPPARALDHAPTPRB
SCHEMBL5402468 0.84 PPARG (1.00) PPARGPPARDPPARALDHA

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-2004113266-A1 DERIVATIVES OF PHENYLALKYL AND PHENOXYALKYL ACIDS FOR THE TREATMENT OF THE HYPERGLYCAEMIA AND HYPERTRIGLYCERIDAEMIA AND TYPE 2 DIABETES AND PROCESS FOR PREPARING THEM SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2004-12-29 WO claimed
WO-2004113266-A1 DERIVATIVES OF PHENYLALKYL AND PHENOXYALKYL ACIDS FOR THE TREATMENT OF THE HYPERGLYCAEMIA AND HYPERTRIGLYCERIDAEMIA AND TYPE 2 DIABETES AND PROCESS FOR PREPARING THEM SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2004-12-29 WO disclosed