SCHEMBL9655971

SCHEMBL9655971

CC(C)=C1CC(=O)N(c2cc(OC(F)F)c(Cl)cc2Cl)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.38
PKM P14618 2/20 0.38
PPOX P50336 6/20 0.33
MAPT P10636 5/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HTT P42858 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX12 P18054 1/20 0.33
CYP2C19 P33261 1/20 0.33
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
NR1I2 O75469 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 3/20 0.31
CASP6 P55212 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 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
SCHEMBL9655604 0.92 PPOX (0.41) GAAPKMPPOXHTTALDH1A1
SCHEMBL9655304 0.89 CYP2C9 (0.43) GAAPKMPPOXMAPTNPSR1
SCHEMBL9655626 0.84 GAA (0.41) GAAPKMPPOXMAPTNPSR1
SCHEMBL9654778 0.84 PKM (0.46) GAAPKMPPOXMAPTNPSR1
SCHEMBL9655637 0.84 PKM (0.41) GAAPKMPPOXMAPTNPSR1
SCHEMBL9654729 0.83 GAA (0.36) GAAPKMPPOXMAPTNPSR1
SCHEMBL9655557 0.83 GAA (0.36) GAAPKMPPOXMAPTNPSR1
SCHEMBL9653027 0.83 RXRA (0.38) MAPTALDH1A1
SCHEMBL9656292 0.82 GAA (0.38) GAAPKMPPOXMAPTNPSR1
SCHEMBL9656139 0.82 PPOX (0.40) GAAPKMPPOXMAPTNPSR1

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-0190755-B1 AN N-SUBSTITUTED-PHENYLTERACONIMIDE COMPOUND, HERBICIDAL COMPOSITION, AND METHOD FOR THE DESTRUCTION OF UNDESIRABLE WEEDS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1992-06-17 EP disclosed
US-4964905-A N-substituted-phenylteraconimide compound, herbicidal composition, and method for the destruction of undesirable weeds ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1990-10-23 US disclosed
EP-0190755-A2 An n-substituted-phenylteraconimide compound, herbicidal composition, and method for the destruction of undesirable weeds Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-08-13 EP disclosed