SCHEMBL6820050

SCHEMBL6820050

CCCc1cc2c(C(F)(F)F)onc2c(CCC)c1OC(C)(C)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.68
PPARG P37231 15/20 0.68
PPARD Q03181 4/20 0.36
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL6819439 0.90 PPARA (0.55) PPARAPPARGFFAR4
SCHEMBL6820298 0.87 PPARA (0.52) PPARAPPARGFFAR4
SCHEMBL6824551 0.82 PPARA (0.48) PPARAPPARGFFAR4
SCHEMBL29561793 0.81 PPARA (1.00) PPARAPPARGPPARD
SCHEMBL3863004 0.81 PPARA (1.00) PPARAPPARGPPARD
SCHEMBL6183795 0.78 PPARG (0.71) PPARAPPARG
SCHEMBL6183969 0.77 PPARG (0.72) PPARAPPARG
SCHEMBL6183260 0.75 PPARG (0.56) PPARAPPARG
SCHEMBL6184321 0.74 PPARG (0.60) PPARAPPARG
SCHEMBL6188420 0.74 PPARG (0.61) PPARAPPARG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1259494-A4 ARYLOXYACETIC ACIDS FOR DIABETES AND LIPID DISORDERS MERCK & CO INC (US) 2004-09-15 EP disclosed
EP-1259494-A1 ARYLOXYACETIC ACIDS FOR DIABETES AND LIPID DISORDERS Merck & Co., Inc. (US) 2002-11-27 EP disclosed
WO-2001060807-A1 ARYLOXYACETIC ACIDS FOR DIABETES AND LIPID DISORDERS MERCK & CO. INC. (US) 2001-08-23 WO disclosed