SCHEMBL12634652

SCHEMBL12634652

COc1ccc(CCN2C(=O)NC(=O)C2=O)cc1C(=O)NCc1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.57
PPARG P37231 4/20 0.57
PPARD Q03181 3/20 0.57
LIPG Q9Y5X9 2/20 0.51
PTGER4 P35408 2/20 0.48
PTGER2 P43116 1/20 0.48
PTPN7 P35236 1/20 0.47
DUSP3 P51452 1/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
PDE10A Q9Y233 1/20 0.45
CNR2 P34972 2/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL12634630 0.91 PPARA (0.59) PPARAPPARGPPARDLIPGPTGER4
SCHEMBL12634679 0.86 PPARA (0.53) PPARAPPARGPPARDLIPGPTGER4
SCHEMBL12635900 0.84 PPARA (0.51) PPARAPPARGPPARDLIPGPTGER4
SCHEMBL12635630 0.84 PPARA (0.52) PPARAPPARGPPARDMEN1ALDH1A1
SCHEMBL12634684 0.84 CNR2 (0.49) PPARAPPARGPPARDMEN1ALDH1A1
SCHEMBL12636176 0.84 PPARD (0.57) PPARAPPARGPPARDLIPGPTGER4
SCHEMBL12635890 0.83 PPARA (0.51) PPARAPPARGPPARDLIPGPTGER4
SCHEMBL12635893 0.83 PPARA (0.51) PPARAPPARGPPARDLIPGPTGER4
SCHEMBL12635895 0.83 PPARA (0.51) PPARAPPARGPPARDLIPGALDH1A1
SCHEMBL12636549 0.83 PPARA (0.51) PPARAPPARGPPARDPTGER4PTGER2

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-2011078370-A1 NOVEL PARABANIC ACID DERIVATIVE AND DRUG HAVING THE SAME AS ACTIVE INGREDIENT 杏林製薬株式会社 (JP) 2011-06-30 WO disclosed