SCHEMBL6529677

SCHEMBL6529677

CCOC(Cc1ccc(C#CCOCCc2ccc(CC)cn2)cc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.53
PPARD Q03181 12/20 0.48
PPARG P37231 10/20 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
SCHEMBL6529553 0.91 PPARA (0.42) PPARAPPARDPPARG
SCHEMBL2361274 0.84 PPARA (0.61) PPARAPPARDPPARG
SCHEMBL2332479 0.84 PPARA (0.61) PPARAPPARDPPARG
SCHEMBL2332774 0.84 PPARA (0.61) PPARAPPARDPPARG
SCHEMBL6813813 0.70 PPARA (0.76) PPARAPPARDPPARG
SCHEMBL14479972 0.69 PPARA (0.60) PPARAPPARDPPARG
SCHEMBL14479945 0.69 PPARA (0.60) PPARAPPARDPPARG
SCHEMBL5803154 0.69 PPARG (0.52) PPARAPPARDPPARG
SCHEMBL14332046 0.69 PPARA (0.60) PPARAPPARDPPARG
SCHEMBL27674855 0.69 PPARA (0.81) PPARAPPARDPPARG

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