SCHEMBL6575862

SCHEMBL6575862

COC(Cc1ccc(CCCCOc2ccc(-c3ccccc3)cc2)cc1)C(=O)O

nearest known ligand 0.86

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.86
PPARA Q07869 15/20 0.86
PPARD Q03181 8/20 0.86
FFAR1 O14842 1/20 0.56
SRR Q9GZT4 2/20 0.54
PSAT1 Q9Y617 2/20 0.54

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
SCHEMBL5391059 1.00 PPARG (0.86) PPARGPPARAPPARDFFAR1SRR
SCHEMBL5396084 0.99 PPARG (0.84) PPARGPPARAPPARDFFAR1SRR
SCHEMBL5386019 0.96 PPARG (0.88) PPARGPPARAPPARDFFAR1SRR
SCHEMBL5374789 0.95 PPARG (0.95) PPARGPPARAPPARDSRRPSAT1
SCHEMBL5380219 0.92 PPARG (1.00) PPARGPPARAPPARDSRRPSAT1
SCHEMBL5380210 0.92 PPARG (1.00) PPARGPPARAPPARDSRRPSAT1
SCHEMBL5390699 0.91 PPARG (0.92) PPARGPPARAPPARDSRRPSAT1
SCHEMBL5379993 0.91 PPARG (0.92) PPARGPPARAPPARDSRRPSAT1
SCHEMBL5375478 0.86 PPARG (0.93) PPARGPPARAPPARD
SCHEMBL14392282 0.86 PPARG (0.71) PPARGPPARAPPARDFFAR1

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-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 WO disclosed