SCHEMBL12635884

SCHEMBL12635884

COc1cc(Oc2ccc(F)cc2)ccc1CNC(=O)c1cccc(CN2C(=O)NC(=O)C2=O)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 7/20 0.46
▸ GAA P10253 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ MAPT P10636 4/20 0.43
▸ EPHX2 P34913 4/20 0.43
▸ PPARD Q03181 3/20 0.43
▸ PPARA Q07869 3/20 0.43
▸ TP53 P04637 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ NAMPT P43490 1/20 0.41

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
SCHEMBL12635890 0.87 PPARA (0.51) PPARGGAAHPGDPPARDPPARA
SCHEMBL12634650 0.87 MAPK14 (0.47) HPGDMAPTTP53
SCHEMBL12634647 0.84 PPARD (0.60) PPARGEPHX2PPARDPPARA
SCHEMBL12634679 0.82 PPARA (0.53) PPARGPPARDPPARA
SCHEMBL12635644 0.81 PPARA (0.49) PPARGGAAHPGDPPARDPPARA
SCHEMBL12636531 0.80 MEN1 (0.49) MAPTTP53LMNA
SCHEMBL12635889 0.79 WDR5 (0.47) MAPT
SCHEMBL12634630 0.79 PPARA (0.59) PPARGPPARDPPARA
SCHEMBL12635893 0.77 PPARA (0.51) PPARGPPARDPPARATP53
SCHEMBL12635638 0.76 LIPG (0.51) PPARGMAPTPPARDPPARATP53

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
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