SCHEMBL5822338

SCHEMBL5822338

CCCc1cc(Oc2ccc(Cl)cc2)ccc1Oc1cccc(CC2(CC)OC(=O)NC2=O)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.46
PPARA Q07869 3/20 0.41
ALDH1A1 P00352 1/20 0.37
PPARD Q03181 1/20 0.37
FDFT1 P37268 1/20 0.37
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37

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
SCHEMBL5822340 1.00 PPARG (0.46) PPARGPPARAALDH1A1PPARDFDFT1
SCHEMBL5822442 0.89 PPARG (0.47) PPARGPPARAALDH1A1PPARDNR1H2
SCHEMBL5630819 0.89 PPARG (0.47) PPARGPPARAALDH1A1PPARDNR1H2
SCHEMBL5175221 0.89 PPARG (0.47) PPARGPPARAALDH1A1PPARDNR1H2
SCHEMBL14528224 0.81 PPARG (0.44) PPARGPPARAALDH1A1PPARDNR1H2
SCHEMBL5175340 0.80 PPARG (0.46) PPARGPPARAALDH1A1PPARDNR1H2
SCHEMBL14459759 0.80 PPARG (0.46) PPARGPPARAALDH1A1PPARDNR1H2
SCHEMBL5175346 0.80 PPARG (0.47) PPARGPPARAPPARD
SCHEMBL13114532 0.78 PPARG (0.41) PPARGPPARAPPARDNR1H2NR1H3
SCHEMBL13114530 0.78 PPARG (0.39) PPARGPPARAPPARDNR1H2NR1H3

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-2006138328-A1 PROCESS FOR THE PRODUCTION OF ANTIDIABETIC OXAZOLIDINEDIONES MERCK & CO., INC. (US) 2006-12-28 WO disclosed