SCHEMBL6633154

SCHEMBL6633154

Cc1oc(-c2ccc(N)cc2)nc1CCOc1ccc(CCC(=O)OC(C)(C)C)c(CCNC(=O)OC(C)C)c1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.62
PPARA Q07869 19/20 0.62
PPARD Q03181 4/20 0.52

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
SCHEMBL4893953 0.93 PPARG (0.71) PPARGPPARAPPARD
SCHEMBL6633152 0.87 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL4891495 0.87 PPARG (0.72) PPARGPPARAPPARD
SCHEMBL4895353 0.87 PPARG (0.72) PPARGPPARAPPARD
SCHEMBL6633155 0.86 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL14111222 0.86 PPARG (0.83) PPARGPPARAPPARD
SCHEMBL4896566 0.86 PPARG (0.71) PPARGPPARAPPARD
SCHEMBL4893873 0.85 PPARG (0.72) PPARGPPARAPPARD
SCHEMBL14111422 0.85 PPARG (0.76) PPARGPPARAPPARD
SCHEMBL4891401 0.85 PPARG (0.69) PPARGPPARAPPARD

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
EP-1401434-A1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) ELI LILLY AND COMPANY (US) 2004-03-31 EP disclosed
WO-2002100403-A1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) ELI LILLY AND COMPANY (US) 2002-12-19 WO disclosed