SCHEMBL6937146

SCHEMBL6937146

CCCc1c(OCCCSc2ccc(C(C)C(=O)O)cc2Cl)ccc(C(CC)=NO)c1OC(C)=O

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.60
PPARD Q03181 8/20 0.60
PPARA Q07869 8/20 0.60
CYSLTR2 Q9NS75 10/20 0.41
CYSLTR1 Q9Y271 10/20 0.41
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
PTGS2 P35354 1/20 0.33

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
SCHEMBL6939647 0.92 PPARG (0.62) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6938580 0.91 PPARG (0.57) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6938970 0.89 PPARG (0.75) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6933003 0.87 PPARD (0.80) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6933007 0.87 PPARD (0.80) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6937003 0.86 PPARG (0.60) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6938100 0.84 PPARG (0.69) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6937010 0.84 PPARG (0.68) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6932943 0.83 PPARG (0.60) PPARGPPARDPPARACYSLTR2CYSLTR1
SCHEMBL6936461 0.83 PPARG (0.59) PPARGPPARDPPARACYSLTR2CYSLTR1

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
EP-0888278-B1 ANTIDIABETIC AGENTS MERCK & CO INC (US) 2003-07-23 EP claimed