SCHEMBL2466313

SCHEMBL2466313

COc1ccc(-c2cc(N)c(Cl)c(OC(=O)O)n2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMO O15229 3/20 0.40
CXCL12 P48061 1/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
GRK6 P43250 1/20 0.39
PPARD Q03181 2/20 0.38
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NEK2 P51955 1/20 0.37

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
SCHEMBL2468353 0.91 MEN1 (0.52) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL2470067 0.88 ALPL (0.40) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL2463132 0.87 ABL1 (0.42) MAPTKMO
SCHEMBL2466299 0.84 KMO (0.47) MAPTKDM4EKMOLMNA
SCHEMBL2467821 0.84 KDM4E (0.48) MAPTKDM4EALDH1A1HPGDHTT
SCHEMBL2466248 0.84 MAPT (0.44) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL2466311 0.83 MAPT (0.45) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL2468160 0.81 CTRC (0.46) MAPTKDM4EMEN1KMT2AKMO
SCHEMBL2464675 0.81 KMO (0.34) MAPTKDM4EMEN1KMT2AKMO
SCHEMBL2465141 0.80 KMO (0.48) MAPTKDM4EMEN1KMT2AKMO

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