SCHEMBL6633976

SCHEMBL6633976

Cc1oc(-c2ccccc2)nc1CCOc1[c]c(CS(=O)(=O)c2ccccc2)ccc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.51
PPARA Q07869 10/20 0.51
POLB P06746 5/20 0.49
MAPT P10636 2/20 0.48
TP53 P04637 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
SCHEMBL5730668 0.83 PPARG (0.54) PPARGPPARA
SCHEMBL5730014 0.83 PPARG (0.53) PPARGPPARA
SCHEMBL6631311 0.81 PPARG (0.55) PPARGPPARA
SCHEMBL6635382 0.80 PPARG (0.58) PPARGPPARA
SCHEMBL6631504 0.80 PPARG (0.50) PPARGPPARAMAPTTP53
SCHEMBL5736143 0.79 PPARG (0.49) PPARGPPARA
SCHEMBL5346336 0.79 PPARG (0.49) PPARGPPARA
SCHEMBL6632292 0.78 PPARA (0.50) PPARGPPARA
SCHEMBL5351857 0.77 TP53 (0.59) PPARGPPARAMAPTTP53
SCHEMBL5730171 0.77 PPARG (0.62) 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