SCHEMBL9656117

SCHEMBL9656117

COC(=O)COc1cc(N2C(=O)CC(=C(C)C)C2=O)c(Cl)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.55
PKM P14618 1/20 0.55
LMNA P02545 1/20 0.54
ALDH1A1 P00352 4/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 5/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PPOX P50336 2/20 0.39
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PTGDR Q13258 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
FKBP1A P62942 1/20 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
SCHEMBL9653035 0.91 PPOX (0.50) GAAPKMLMNAALDH1A1HPGD
SCHEMBL9655595 0.90 GAA (0.56) GAAPKMLMNAALDH1A1HPGD
SCHEMBL9656477 0.89 PKM (0.71) GAAPKMLMNAALDH1A1HPGD
SCHEMBL9655346 0.86 GAA (0.49) GAAPKMLMNAKDM4EL3MBTL1
SCHEMBL9654864 0.84 GAA (0.52) GAAPKMLMNAALDH1A1KDM4E
SCHEMBL9654762 0.84 LMNA (0.46) GAAPKMLMNAALDH1A1HPGD
SCHEMBL9652995 0.84 L3MBTL1 (0.51) GAAPKMLMNAALDH1A1HPGD
SCHEMBL9654778 0.83 PKM (0.46) GAAPKMALDH1A1HPGDMAPK1
SCHEMBL9655614 0.82 GAA (0.45) GAAPKMLMNAALDH1A1L3MBTL1
SCHEMBL9655608 0.82 GAA (0.45) GAAPKMALDH1A1L3MBTL1PPOX

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
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