SCHEMBL2465145

SCHEMBL2465145

CCCCOc1c(Cl)ccc(-c2cc(N)c(Cl)c(OC(=O)OC)n2)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.37
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
MAPK9 P45984 3/20 0.35
MAPK8 P45983 2/20 0.35
FFAR4 Q5NUL3 1/20 0.34
HTT P42858 1/20 0.34
RECQL P46063 1/20 0.34
BCHE P06276 1/20 0.34
LIPE Q05469 1/20 0.34
MAPK1 P28482 2/20 0.33
PRKD2 Q9BZL6 2/20 0.33
PRKD3 O94806 1/20 0.33
MAPK10 P53779 1/20 0.33
SGK1 O00141 2/20 0.33
LIMK1 P53667 1/20 0.33
LIMK2 P53671 1/20 0.33
CNR2 P34972 1/20 0.33
CSF1R P07333 1/20 0.33
CSNK1D P48730 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
SCHEMBL2466895 0.92 MAPK9 (0.38) ALOX5APFEN1MAPK9MAPK8MAPK1
SCHEMBL2466455 0.91 ALOX5AP (0.36) ALOX5APFEN1MAPK9MAPK8FFAR4
SCHEMBL2467067 0.90 FFAR4 (0.37) CNR1ALOX5APFEN1MAPK9MAPK8
SCHEMBL2469695 0.89 ALOX5AP (0.36) ALOX5APFEN1MAPK9MAPK8FFAR4
SCHEMBL2468807 0.89 MEP1B (0.36) ALOX5APFEN1ALPLSCN10A
SCHEMBL2470071 0.88 ALOX5AP (0.36) ALOX5APFEN1MAPK9MAPK8FFAR4
SCHEMBL2467740 0.85 SMN1; SMN2 (0.34) CNR1MAPK9MAPK8FFAR4HTT
SCHEMBL2466510 0.85 MAPK9 (0.33) FEN1MAPK9MAPK8MAPK1PRKD2
SCHEMBL2468405 0.85 PTGES (0.34) ALOX5APFEN1MAPK9MAPK8MAPK10
SCHEMBL2469824 0.85 MAPK9 (0.40) MAPK9MAPK8MAPK1PRKD2PRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2939540-A1 HERBICIDE SAFENER COMBINATION Bayer Intellectual Property GmbH (DE) 2015-11-04 EP disclosed
EP-2939541-A1 HERBICIDE SAFENER COMBINATION Bayer Intellectual Property GmbH (DE) 2015-11-04 EP disclosed
EP-2369929-A2 HERBICIDE-SAFENER COMBINATION Bayer CropScience AG (DE) 2011-10-05 EP disclosed
WO-2010060581-A2 HERBICIDE-SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 WO disclosed
EP-2191719-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP disclosed