SCHEMBL12635637

SCHEMBL12635637

COc1ccc(CN2C(=O)NC(=O)C2=O)cc1C(=O)NCc1ccc(OCCc2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.62
PPARG P37231 8/20 0.62
PPARD Q03181 4/20 0.47
HPGD P15428 2/20 0.46
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
BRD4 O60885 1/20 0.45
HTT P42858 2/20 0.45
TSHR P16473 2/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
POLB P06746 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
SCHEMBL12635902 0.92 PPARA (0.58) PPARAPPARGPPARDHPGDTP53
SCHEMBL12636580 0.91 PPARA (0.61) PPARAPPARGPPARDHPGDTP53
SCHEMBL12635645 0.88 PPARA (0.59) PPARAPPARGPPARDHPGDTP53
SCHEMBL12635636 0.88 PPARA (0.53) PPARAPPARGPPARDHPGDTP53
SCHEMBL12635899 0.86 PPARA (0.58) PPARAPPARGPPARDHPGDTP53
SCHEMBL12636549 0.85 PPARA (0.51) PPARAPPARGPPARDHPGDHTT
SCHEMBL12635630 0.85 PPARA (0.52) PPARAPPARGPPARDHTTALDH1A1
SCHEMBL12634630 0.84 PPARA (0.59) PPARAPPARGPPARDHTTPOLB
SCHEMBL12635895 0.84 PPARA (0.51) PPARAPPARGPPARDHPGDHTT
SCHEMBL12636568 0.83 PTGER4 (0.52) PPARAPPARGPPARD

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