SCHEMBL9656332

SCHEMBL9656332

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

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
HTR2C P28335 5/20 0.37
BCL2A1 Q16548 2/20 0.36
HTR2B P41595 1/20 0.35
HTR1A P08908 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RXRA P19793 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
LMNA P02545 2/20 0.34
ADRA1B P35368 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
HTR2A P28223 1/20 0.33
HTT P42858 1/20 0.33
MCHR1 Q99705 1/20 0.33

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
SCHEMBL9656317 0.93 RXRA (0.40) ALDH1A1KDM4EMAPTHTR2CHTR1A
SCHEMBL9656399 0.91 KDM4E (0.37) ALDH1A1KDM4EMAPTHTR2CHTR1A
SCHEMBL9656492 0.91 KDM4E (0.42) ALDH1A1KDM4EMAPTHTR2CHTR1A
SCHEMBL9655561 0.90 ALDH1A1 (0.39) ALDH1A1KDM4EMAPTHTR2CHTR2B
SCHEMBL9653007 0.90 KDM4E (0.39) ALDH1A1KDM4EMAPTHTR2CBCL2A1
SCHEMBL9652980 0.90 ALDH1A1 (0.37) ALDH1A1KDM4EMAPTHTR2CHTR2B
SCHEMBL9654776 0.89 THRB (0.39) ALDH1A1KDM4EMAPTBCL2A1HTR1A
SCHEMBL9653017 0.88 ALDH1A1 (0.40) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL9654809 0.88 MAPT (0.35) ALDH1A1KDM4EMAPTHTR2CHTR1A
SCHEMBL9656036 0.88 KDM4E (0.35) ALDH1A1KDM4EMAPTHTR2CHTR1A

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