SCHEMBL6533895

SCHEMBL6533895

O=C(c1ccccc1)c1ccccc1N[C@@H](Cc1ccc(C#CCN2CCSc3ccccc32)cc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.50
PPARA Q07869 1/20 0.46

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
SCHEMBL6528869 0.77 PPARG (0.46) PPARGPPARA
SCHEMBL6527236 0.77 NPSR1 (0.46) PPARGPPARA
SCHEMBL6528743 0.75 PPARG (0.44) PPARGPPARA
SCHEMBL6530163 0.74 PPARG (0.56) PPARGPPARA
SCHEMBL9751930 0.72 PPARG (0.79) PPARGPPARA
SCHEMBL290549 0.71 PPARG (0.76) PPARGPPARA
SCHEMBL2217249 0.71 PPARG (0.76) PPARGPPARA
SCHEMBL6530937 0.68 PPARG (0.44) PPARGPPARA
SCHEMBL6532625 0.68 MAPT (0.40)
SCHEMBL8335329 0.68 PPARG (0.72) PPARGPPARA

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-2005056536-A1 ANTIDIABETIC AGENTS WHICH EXHIBIT ACTIVITY AGAINST PPAR RANBAXY LABORATORIES LIMITED (IN) 2005-06-23 WO claimed