SCHEMBL2464677

SCHEMBL2464677

CCOc1c(Cl)cc(F)c(-c2cc(N)c(Cl)c(OC(=O)OC)n2)c1F

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
MAPK9 P45984 4/20 0.34
MAPK8 P45983 3/20 0.34
MAPK10 P53779 3/20 0.34
PRKD2 Q9BZL6 3/20 0.34
MAPK1 P28482 2/20 0.34
PRKD3 O94806 2/20 0.34
SGK1 O00141 1/20 0.34
FRK P42685 1/20 0.33
CSF1R P07333 1/20 0.33
CSNK1D P48730 1/20 0.33
MAP4K4 O95819 1/20 0.31
MAP4K2 Q12851 1/20 0.31
PKN2 Q16513 1/20 0.31
STK17A Q9UEE5 1/20 0.31
BDKRB1 P46663 1/20 0.31
ACACB O00763 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
SCHEMBL2464658 0.91 KDM4E (0.33) MAPK9MAPK8
SCHEMBL17797219 0.90 LMNA (0.36) LMNAHTTMAPK9MAPK8MAPK10
SCHEMBL2466895 0.85 MAPK9 (0.38) MAPK9MAPK8MAPK10PRKD2MAPK1
SCHEMBL2470878 0.84 NQO2 (0.32)
SCHEMBL2467726 0.84 PDCD1LG2 (0.31) MAPK9MAPK8
SCHEMBL2467774 0.84 KDM4E (0.33) MAPK9MAPK8
SCHEMBL3328434 0.84 LMNA (0.36) LMNAHTTMAPK9MAPK8MAPK10
SCHEMBL2465634 0.83 MAPK9 (0.38) MAPK9MAPK8MAPK10PRKD2MAPK1
SCHEMBL2466386 0.82 PDCD1LG2 (0.30)
SCHEMBL2467547 0.82 NQO2 (0.31)

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-2939541-A1 HERBICIDE SAFENER COMBINATION Bayer Intellectual Property GmbH (DE) 2015-11-04 EP disclosed
EP-2939540-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