SCHEMBL8357976

SCHEMBL8357976

CNC(=O)/C(=N\OC)c1cc(CO/N=C(/C)c2cccc(C(F)(F)F)c2)ccc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.44
PPARA Q07869 3/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.39
RAF1 P04049 1/20 0.39
S1PR1 P21453 3/20 0.38
MAOB P27338 1/20 0.38
HIF1A Q16665 2/20 0.38
ABL1 P00519 1/20 0.38
LCK P06239 1/20 0.38
KIT P10721 1/20 0.38
SRC P12931 1/20 0.38
MAPK14 Q16539 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL8355862 0.88 HIF1A (0.42) PPARGPPARAS1PR1MAOBHIF1A
SCHEMBL8355865 0.88 HIF1A (0.42) PPARGPPARAS1PR1MAOBHIF1A
SCHEMBL23971573 0.86 MEN1 (0.42) PPARGPPARAMEN1KMT2AGAA
SCHEMBL7072847 0.86 KMT2A (0.42) PPARGPPARAMEN1KMT2AGAA
SCHEMBL30401554 0.86 MEN1 (0.42) PPARGPPARAMEN1KMT2AGAA
SCHEMBL7072848 0.86 KMT2A (0.42) PPARGPPARAMEN1KMT2AGAA
SCHEMBL14141835 0.84 HIF1A (0.52) PPARGPPARAMEN1KMT2AGAA
SCHEMBL828172 0.84 HIF1A (0.52) PPARGPPARAMEN1KMT2AGAA
SCHEMBL123529 0.84 HIF1A (0.52) PPARGPPARAMEN1KMT2AGAA
SCHEMBL483559 0.84 HIF1A (0.52) PPARGPPARAMEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999028305-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-06-10 WO claimed
WO-1999028305-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-06-10 WO disclosed