SCHEMBL2596680

SCHEMBL2596680

CCC(C)OC(=O)Oc1nc(-c2ccc(Cl)c(OC)c2F)cc(N)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDCD1LG2 Q9BQ51 7/20 0.32
CD274 Q9NZQ7 7/20 0.32
MEP1B Q16820 1/20 0.32
SCN10A Q9Y5Y9 1/20 0.32
ALOX5AP P20292 2/20 0.31
FEN1 P39748 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
PTGES O14684 1/20 0.31
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL13822296 0.90 SCN10A (0.33) PDCD1LG2CD274MEP1BSCN10AALOX5AP
SCHEMBL2468807 0.88 MEP1B (0.36) PDCD1LG2CD274MEP1BSCN10AALOX5AP
SCHEMBL2465727 0.86 MEP1B (0.34) PDCD1LG2CD274MEP1BALOX5APFEN1
SCHEMBL678814 0.85 MEP1B (0.32) MEP1BSCN10AALOX5APFEN1ADORA3
SCHEMBL2596683 0.85 DHPS (0.32) MEP1BSCN10A
SCHEMBL2466895 0.83 MAPK9 (0.38) PDCD1LG2CD274ALOX5APFEN1PTGES
SCHEMBL2467541 0.82 ALDH1A1 (0.37) PDCD1LG2CD274MEP1BSCN10AALOX5AP
SCHEMBL2596708 0.82 ALOX5AP (0.33) PDCD1LG2CD274MEP1BALOX5APFEN1
SCHEMBL2465145 0.82 CNR1 (0.37) SCN10AALOX5APFEN1MAPK8MAPK9
SCHEMBL2470407 0.81 PDCD1LG2 (0.38) PDCD1LG2CD274SCN10AMAPK8MAPK9

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2571364-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RICE CULTURES Bayer Intellectual Property GmbH (DE) 2013-03-27 EP claimed
EP-2571365-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT GRAIN CULTURES Bayer Intellectual Property GmbH (DE) 2013-03-27 EP claimed
EP-2571363-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RAPE CULTURES Bayer Intellectual Property GmbH (DE) 2013-03-27 EP claimed
EP-2571366-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT CORN CULTURES Bayer Intellectual Property GmbH (DE) 2013-03-27 EP claimed
EP-2524602-A1 Herbicide agent for tolerant or resistant soya cultures Bayer CropScience AG (DE) 2012-11-21 EP claimed
WO-2011144691-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT CORN CULTURES BAYER CROPSCIENCE AG (DE) 2011-11-24 WO claimed
WO-2011144685-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT GRAIN CULTURES BAYER CROPSCIENCE AG (DE) 2011-11-24 WO claimed
WO-2011144684-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RICE CULTURES BAYER CROPSCIENCE AG (DE) 2011-11-24 WO claimed
WO-2011144683-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RAPE CULTURES BAYER CROPSCIENCE AG (DE) 2011-11-24 WO claimed
EP-2571364-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RICE CULTURES Bayer Intellectual Property GmbH (DE) 2013-03-27 EP disclosed
EP-2571365-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT GRAIN CULTURES Bayer Intellectual Property GmbH (DE) 2013-03-27 EP disclosed
EP-2571363-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RAPE CULTURES Bayer Intellectual Property GmbH (DE) 2013-03-27 EP disclosed
EP-2524602-A1 Herbicide agent for tolerant or resistant soya cultures Bayer CropScience AG (DE) 2012-11-21 EP disclosed
WO-2011144683-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RAPE CULTURES BAYER CROPSCIENCE AG (DE) 2011-11-24 WO disclosed
WO-2011144684-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT RICE CULTURES BAYER CROPSCIENCE AG (DE) 2011-11-24 WO disclosed
WO-2011144685-A1 HERBICIDAL AGENTS FOR TOLERANT OR RESISTANT GRAIN CULTURES BAYER CROPSCIENCE AG (DE) 2011-11-24 WO disclosed