SCHEMBL8589528

SCHEMBL8589528

CNC(=O)/C(=N\OC)c1ccccc1/C=N/OC(C)c1ccc(C2CCc3ccccc32)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33
MAPK14 Q16539 1/20 0.33
PIN1 Q13526 1/20 0.32
HAO1 Q9UJM8 1/20 0.31

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
SCHEMBL8589531 1.00 MAPK1 (0.33) MAPK1MAPK14PIN1HAO1
SCHEMBL27493800 0.82 LMNA (0.36)
SCHEMBL27479699 0.81 HIF1A (0.35)
SCHEMBL9262139 0.78 HIF1A (0.34)
SCHEMBL3681233 0.75 HIF1A (0.34)
SCHEMBL3681235 0.75 HIF1A (0.34)
SCHEMBL8528118 0.75 HIF1A (0.46) MAPK1MAPK14PIN1HAO1
SCHEMBL8534740 0.74 GRIN2B (0.35)
SCHEMBL8461974 0.72 HIF1A (0.36)
SCHEMBL154409 0.72 HIF1A (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0877730-A1 ARYL ACRYLICS FOR USE AS FUNGICIDE MONSANTO COMPANY (US) 1998-11-18 EP disclosed
WO-1997016413-A9 ARYL ACRYLICS FOR USE AS FUNGICIDE 1997-08-14 WO disclosed
WO-1997016413-A1 ARYL ACRYLICS FOR USE AS FUNGICIDE MONSANTO COMPANY (US) 1997-05-09 WO disclosed