SCHEMBL7973815

SCHEMBL7973815

CO/N=C(/C(=N)N)c1ccccc1CO/N=C(/C)c1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.47
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
GAA P10253 1/20 0.36
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RXFP1 Q9HBX9 2/20 0.34

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
SCHEMBL7973818 1.00 HIF1A (0.47) HIF1AKMT2AMEN1NPSR1PPARG
SCHEMBL7973685 0.90 HIF1A (0.49) HIF1AKMT2AMEN1NPSR1PPARG
SCHEMBL7973803 0.90 HIF1A (0.52) HIF1AKMT2AMEN1PPARGPPARA
SCHEMBL7973807 0.90 HIF1A (0.52) HIF1AKMT2AMEN1PPARGPPARA
SCHEMBL27039060 0.87 HIF1A (0.52) HIF1AKMT2AMEN1NPSR1PPARG
SCHEMBL28652083 0.87 HIF1A (0.52) HIF1AKMT2AMEN1NPSR1PPARG
SCHEMBL26650820 0.87 HIF1A (0.52) HIF1AKMT2AMEN1NPSR1PPARG
SCHEMBL5112727 0.87 HIF1A (0.52) HIF1AKMT2AMEN1NPSR1PPARG
SCHEMBL2792522 0.87 HIF1A (0.52) HIF1AKMT2AMEN1NPSR1PPARG
SCHEMBL2792516 0.87 HIF1A (0.52) HIF1AKMT2AMEN1NPSR1PPARG

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
US-6194464-B1 METHYL N-CYANO-2-(E-2-METHOXIMINO)-2-(2-(1-(3-TRIFLUOROMETHYL-PHENYL) -ETHYLIDENEIMINOOXY-METHYL)-PHENYL)-ACETIMIDATE, FOR EXAMPLE; FOR USE AS FUNGICIDES ON PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2001-02-27 US disclosed