SCHEMBL9655561

SCHEMBL9655561

COCCOc1cc(N2C(=O)CC(=C(C)C)C2=O)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
KMO O15229 2/20 0.37
POLB P06746 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
USP2 O75604 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
HTR2C P28335 3/20 0.35
NTRK1 P04629 2/20 0.35
NTRK3 Q16288 2/20 0.35

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 0.90 RXRA (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL9656399 0.90 KDM4E (0.37) ALDH1A1MAPTKDM4EPOLBL3MBTL1
SCHEMBL9656332 0.90 ALDH1A1 (0.37) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL9656492 0.90 KDM4E (0.42) ALDH1A1MAPTKDM4EPOLBL3MBTL1
SCHEMBL9654809 0.89 MAPT (0.35) ALDH1A1MAPTKDM4EPOLBL3MBTL1
SCHEMBL9653007 0.89 KDM4E (0.39) ALDH1A1MAPTKDM4EPOLBL3MBTL1
SCHEMBL9652980 0.89 ALDH1A1 (0.37) ALDH1A1MAPTKDM4EPOLBL3MBTL1
SCHEMBL9652874 0.88 HPGD (0.39) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL9654776 0.88 THRB (0.39) ALDH1A1MAPTKDM4EPOLBL3MBTL1
SCHEMBL9653017 0.87 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A

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