SCHEMBL27979261

SCHEMBL27979261

NC(=O)c1c(Cl)ncc(-c2ccccc2)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 2/20 0.43
CDC7 O00311 2/20 0.42
CASP1 P29466 1/20 0.42
CHEK2 O96017 3/20 0.41
MKNK1 Q9BUB5 2/20 0.41
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.38
MAP2 P11137 1/20 0.38
PLK4 O00444 2/20 0.38
CHEK1 O14757 2/20 0.38
AURKA O14965 2/20 0.38
CDK1 P06493 2/20 0.38
CSF1R P07333 2/20 0.38
PIM1 P11309 2/20 0.38
FGFR1 P11362 2/20 0.38
FLT1 P17948 2/20 0.38
FGFR3 P22607 2/20 0.38
RPS6KB1 P23443 2/20 0.38

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
SCHEMBL28143127 0.79 CDC7 (0.46) BCAT2CDC7CASP1CHEK2MKNK1
SCHEMBL23235003 0.73 POLB (0.40) KMT2AMEN1LMNA
SCHEMBL845186 0.70 POLB (0.38) CDC7LMNA
SCHEMBL27904171 0.70 POLB (0.50) MAPK1CYP2C19
SCHEMBL22836873 0.70 POLB (0.38) CASP1AURKAAURKBLMNA
SCHEMBL27824725 0.70 CHEK2 (0.50) BCAT2CHEK2MKNK1KMT2AMEN1
SCHEMBL22371311 0.70 USP7 (0.48) BCAT2CHEK2MKNK1KMT2AMEN1
SCHEMBL28313057 0.70 PLA2G10 (0.41) KMT2AMEN1GAALMNAFYN
SCHEMBL7085409 0.69 BCAT2 (0.53) BCAT2KMT2AMAP2FGFR1FGFR3
SCHEMBL27980296 0.69 POLB (0.41) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104170838-B Active agent combinations BAYER LANDWIRTSCHAFTLICHE KULTURPFLANZEN SCIENCE AG (DE) 2016-03-30 CN disclosed
CN-104170838-A ACTIVE SUBSTANCE COMBINATIONS BAYER CROPSCIENCE AG 2014-12-03 CN disclosed
CN-101237777-B Active substance combinations BAYER CROPSCIENCE AG 2014-11-19 CN disclosed