SCHEMBL1082175

SCHEMBL1082175

CCC(C)(Oc1ccc(C(=O)CCc2sc3ccc(C(F)(F)F)cc3c2C)cc1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.37
PPARD Q03181 7/20 0.37
PPARG P37231 6/20 0.37
TBXAS1 P24557 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
CSNK1D P48730 1/20 0.33
CNR2 P34972 1/20 0.33
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN12 Q05209 1/20 0.33
PTPN22 Q9Y2R2 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
SCHEMBL1035195 0.82 PPARA (0.40) PPARAPPARDPPARGTBXAS1
SCHEMBL1034265 0.81 IDH1 (0.43) PPARD
SCHEMBL1030631 0.81 PPARD (0.44) PPARAPPARDPPARG
SCHEMBL1032891 0.77 BCL2L1 (0.37) TBXAS1
SCHEMBL1030579 0.77 FBP1 (0.38) PPARAPPARDPPARG
SCHEMBL27829362 0.76 KCNK3 (0.41) TBXAS1CNR2
SCHEMBL1035193 0.76 PPARD (0.47) PPARAPPARDPPARG
SCHEMBL4655072 0.76 LMNA (0.38) PPARG
SCHEMBL1082173 0.75 PPARD (0.46) PPARAPPARDPPARGTBXAS1
SCHEMBL1032853 0.75 PPARA (0.40) PPARAPPARDPPARG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3424917-A1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR Nippon Chemiphar Co., Ltd. (JP) 2019-01-09 EP disclosed
EP-2277874-B1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR NIPPON CHEMIPHAR CO (JP) 2018-06-27 EP disclosed
EP-2277874-A1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR Nippon Chemiphar Co., Ltd. (JP) 2011-01-26 EP disclosed