SCHEMBL2465720

SCHEMBL2465720

Cc1ccc(-c2cc(N)c(Cl)c(OC(=O)O)n2)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
DBF4 Q9UBU7 1/20 0.39
HSP90AA1 P07900 3/20 0.37
HSP90AB1 P08238 3/20 0.37
EIF4E P06730 2/20 0.36
MAPK1 P28482 3/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
HPGD P15428 3/20 0.34
TSHR P16473 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GRM2 Q14416 2/20 0.34
DHODH Q02127 1/20 0.34
FFAR1 O14842 1/20 0.33
MAPK9 P45984 2/20 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
SCHEMBL2469707 0.90 ALPL (0.41) CDC7CCNE1CDK2DBF4HSP90AB1
SCHEMBL2464666 0.88 GRM2 (0.40) CDC7CCNE1CDK2DBF4GRM2
SCHEMBL2468346 0.87 HSP90AA1 (0.47) HSP90AA1HSP90AB1NPC1RAB9ANPSR1
SCHEMBL2465856 0.86 PPARA (0.36) HSP90AA1HSP90AB1MAPK1NPSR1MAPK9
SCHEMBL2466413 0.85 GRM2 (0.41) CDC7DBF4HSP90AA1HSP90AB1EIF4E
SCHEMBL2466248 0.84 MAPT (0.44) HPGDTP53TDP1L3MBTL1DHODH
SCHEMBL2464096 0.83 HSP90AA1 (0.46) HSP90AA1HSP90AB1NPC1RAB9AHPGD
SCHEMBL2470388 0.82 GRM2 (0.41) HSP90AA1HSP90AB1TSHRGRM2FFAR1
SCHEMBL2469850 0.82 PPARA (0.33) HSP90AA1HSP90AB1EIF4E
SCHEMBL2466891 0.82 NPSR1 (0.42) EIF4EHPGDNPSR1FFAR1KDM4E

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