SCHEMBL31940

SCHEMBL31940

COc1ccc(CN2C(=O)NC(=O)C2(C)C)cc1C(=O)NCc1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.58
PPARD Q03181 4/20 0.58
PPARG P37231 2/20 0.58
PTGER4 P35408 2/20 0.49
LIPG Q9Y5X9 2/20 0.49
PTGER2 P43116 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.46
PDE10A Q9Y233 1/20 0.46
PTPN7 P35236 1/20 0.45
DUSP3 P51452 1/20 0.45
CNR2 P34972 2/20 0.45
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL31780 0.86 PPARD (0.53) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL12634630 0.83 PPARA (0.59) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL31948 0.82 PPARA (0.58) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL12636184 0.79 PPARA (0.59) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL12636546 0.79 PPARA (0.61) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL12634669 0.78 PPARA (0.61) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL31861 0.78 PPARD (0.64) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL12634663 0.78 PPARA (0.60) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL12634652 0.78 PPARA (0.57) PPARAPPARDPPARGPTGER4LIPG
SCHEMBL12636176 0.77 PPARD (0.57) PPARAPPARDPPARGPTGER4LIPG

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-2012026495-A1 NOVEL HYDANTOIN DERIVATIVE AND MEDICINAL AGENT COMPRISING SAME AS ACTIVE INGREDIENT 杏林製薬株式会社 (JP) 2012-03-01 WO disclosed