SCHEMBL9656142

SCHEMBL9656142

CC(C)=C1CC(=O)N(c2ccc(Cl)c(OC(C)c3ccccc3)c2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.42
SLC6A4 P31645 1/20 0.39
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMO O15229 2/20 0.34
SCN1A P35498 3/20 0.34
SCN5A Q14524 3/20 0.34
SCN8A Q9UQD0 3/20 0.34
S1PR5 Q9H228 2/20 0.34
S1PR1 P21453 1/20 0.34
LTB4R Q15722 2/20 0.33
LTB4R2 Q9NPC1 2/20 0.33
NOS2 P35228 1/20 0.33
CASP6 P55212 1/20 0.33
HSD17B2 P37059 1/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
ALOX12 P18054 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL9656338 0.87 ALDH1A1 (0.39) RORCMAPTKDM4EALDH1A1KMO
SCHEMBL9655388 0.86 RORC (0.46) RORCSLC6A4MAPTKMOSCN1A
SCHEMBL9653027 0.83 RXRA (0.38) MAPTKDM4EALDH1A1
SCHEMBL9655645 0.83 PTGDR (0.39) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL9656397 0.82 RORC (0.43) RORCKMOSCN1ASCN5ASCN8A
SCHEMBL9656287 0.82 ALDH1A1 (0.37) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL9655570 0.82 ALDH1A1 (0.35) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL9655541 0.81 ALDH1A1 (0.42) MAPTKDM4EALDH1A1MEN1GAA
SCHEMBL9655555 0.81 LMNA (0.45) MAPTKDM4EALDH1A1MEN1GAA
SCHEMBL9655607 0.79 PPOX (0.44) MAPTKDM4EALDH1A1MEN1GAA

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