SCHEMBL6635382

SCHEMBL6635382

Cc1oc(-c2ccccc2)nc1CCOc1[c]c(COc2ccc(-c3ccccc3)cc2)ccc1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.58
PPARA Q07869 16/20 0.58
FFAR1 O14842 1/20 0.53
PPARD Q03181 4/20 0.50

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
SCHEMBL5730014 0.89 PPARG (0.53) PPARGPPARA
SCHEMBL6632292 0.88 PPARA (0.50) PPARGPPARAPPARD
SCHEMBL5736143 0.87 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL5730668 0.85 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL6631504 0.82 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL5349232 0.80 PPARA (0.51) PPARGPPARAPPARD
SCHEMBL5729514 0.80 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL6633976 0.80 PPARG (0.51) PPARGPPARA
SCHEMBL5350843 0.80 PPARG (0.51) PPARGPPARA
SCHEMBL5346000 0.79 EPHX1 (0.48) 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 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