SCHEMBL7976341

SCHEMBL7976341

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(/N=C3\SCC(=O)N3CCF)c(Cl)cc2F)c1=O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.30
OPRK1 P41145 1/20 0.30
RAB9A P51151 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL7976343 1.00 L3MBTL1 (0.37) L3MBTL1MAPTMAPK1OPRK1RAB9A
SCHEMBL7977660 0.93 L3MBTL1 (0.39) L3MBTL1MAPTMAPK1OPRK1RAB9A
SCHEMBL7977662 0.93 L3MBTL1 (0.39) L3MBTL1MAPTMAPK1OPRK1RAB9A
SCHEMBL8116917 0.92 L3MBTL1 (0.46) L3MBTL1MAPTNPSR1
SCHEMBL8116916 0.92 L3MBTL1 (0.46) L3MBTL1MAPTNPSR1
SCHEMBL7982117 0.91 L3MBTL1 (0.36) L3MBTL1MAPT
SCHEMBL7982118 0.91 L3MBTL1 (0.36) L3MBTL1MAPT
SCHEMBL7690629 0.91 L3MBTL1 (0.37) L3MBTL1MAPT
SCHEMBL7690627 0.91 L3MBTL1 (0.37) L3MBTL1MAPT
SCHEMBL7688387 0.91 L3MBTL1 (0.35) L3MBTL1MAPTMAPK1OPRK1RAB9A

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
US-6303783-B1 1- (3-Heterocyclylphenyl) isothiourea, -isourea, -guanidine and -amidine herbicidal agents AMERICAN CYANAMID CO. 2001-10-16 US disclosed
EP-0985670-A1 1-(3-Heterocyclylphenyl)isothiourea, -isourea, -guanidine and -amidine compounds as herbicides American Cyanamid Company (US) 2000-03-15 EP disclosed