SCHEMBL6166556

SCHEMBL6166556

CCC(Cc1ccc(OCc2cc(-c3ccc(Cl)cc3)oc2C(F)(F)F)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.49
PPARG P37231 13/20 0.47
PPARA Q07869 10/20 0.47
EPHX2 P34913 6/20 0.44
GPR34 Q9UPC5 1/20 0.43
PPARD Q03181 6/20 0.43
S1PR1 P21453 1/20 0.42
S1PR3 Q99500 1/20 0.42
S1PR5 Q9H228 1/20 0.42
FFAR4 Q5NUL3 1/20 0.40

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
SCHEMBL5861867 0.84 FFAR1 (0.58) PTGER4PPARGPPARAPPARDFFAR4
SCHEMBL6166560 0.81 PTGER4 (0.47) PTGER4PPARGPPARAPPARDFFAR4
SCHEMBL5860681 0.80 PTGER4 (0.47) PTGER4PPARGPPARAEPHX2PPARD
SCHEMBL5860821 0.77 FFAR4 (0.54) PTGER4PPARGPPARAPPARDFFAR4
SCHEMBL5862763 0.75 PPARD (0.60) PPARAPPARD
SCHEMBL5860732 0.73 PPARD (0.51) PTGER4PPARGPPARAPPARD
SCHEMBL6165375 0.73 FFAR4 (0.44) PTGER4PPARGPPARAPPARDFFAR4
SCHEMBL27584938 0.72 MCHR1 (0.46) PTGER4
SCHEMBL3905035 0.72 PPARD (0.43) PTGER4PPARGPPARAPPARD
SCHEMBL5861910 0.71 PPARA (0.47) PTGER4PPARAPPARD

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-1392674-B1 FURAN AND THIOPHENE DERIVATIVES THAT ACTIVATE HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS SMITHKLINE BEECHAM CORP (US) 2005-08-10 EP disclosed