SCHEMBL9656399

SCHEMBL9656399

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
HTR2C P28335 3/20 0.35
HTR1A P08908 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
ADRA1B P35368 1/20 0.34
LMNA P02545 2/20 0.33
HTR2A P28223 1/20 0.33
HTT P42858 1/20 0.33
GAA P10253 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RXRA P19793 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
SCHEMBL9656492 0.91 KDM4E (0.42) KDM4EALDH1A1MAPTHTR2CHTR1A
SCHEMBL9656317 0.91 RXRA (0.40) KDM4EALDH1A1MAPTHTR2CHTR1A
SCHEMBL9656332 0.91 ALDH1A1 (0.37) KDM4EALDH1A1MAPTHTR2CHTR1A
SCHEMBL9655561 0.90 ALDH1A1 (0.39) KDM4EALDH1A1MAPTHTR2CHTR1A
SCHEMBL9652980 0.90 ALDH1A1 (0.37) KDM4EALDH1A1MAPTHTR2CHTR1A
SCHEMBL9653007 0.90 KDM4E (0.39) KDM4EALDH1A1MAPTHTR2CHTR1A
SCHEMBL9654776 0.89 THRB (0.39) KDM4EALDH1A1MAPTHTR1AMEN1
SCHEMBL9653017 0.88 ALDH1A1 (0.40) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL9654809 0.88 MAPT (0.35) KDM4EALDH1A1MAPTHTR2CHTR1A
SCHEMBL9656036 0.88 KDM4E (0.35) KDM4EALDH1A1MAPTHTR2CHTR1A

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