SCHEMBL6532464

SCHEMBL6532464

CCOC(Cc1ccc(C#CCN2CCOc3ccccc32)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.54
PPARG P37231 14/20 0.54
PPARD Q03181 10/20 0.45

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
SCHEMBL6531482 0.92 PPARG (0.45) PPARAPPARGPPARD
SCHEMBL5107356 0.82 PPARG (0.69) PPARAPPARGPPARD
SCHEMBL14265753 0.82 PPARG (0.69) PPARAPPARGPPARD
SCHEMBL6533008 0.82 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL1858219 0.80 PPARG (0.54) PPARAPPARGPPARD
SCHEMBL6684120 0.79 PPARG (0.55) PPARAPPARGPPARD
SCHEMBL4823788 0.78 PPARG (0.54) PPARAPPARGPPARD
SCHEMBL1868139 0.78 PPARG (0.54) PPARAPPARGPPARD
SCHEMBL4827197 0.78 PPARG (0.54) PPARAPPARGPPARD
SCHEMBL4826375 0.78 PPARG (0.54) PPARAPPARGPPARD

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-2005100318-A1 ALKANOIC ACIDS AND THEIR ESTERS AS ANTIDIABETIC AGENTS RANBAXY LABORATORIES LIMITED (US) 2005-10-27 WO claimed
WO-2005100318-A1 ALKANOIC ACIDS AND THEIR ESTERS AS ANTIDIABETIC AGENTS RANBAXY LABORATORIES LIMITED (US) 2005-10-27 WO disclosed