SCHEMBL6809996

SCHEMBL6809996

NC(=O)c1cccc2nc(-c3ccncc3)[nH]c12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKN1 Q16512 9/20 0.63
PKN2 Q16513 9/20 0.63
CHEK2 O96017 2/20 0.63
PLK4 O00444 1/20 0.63
MAPK13 O15264 1/20 0.63
DYRK3 O43781 1/20 0.63
ROCK2 O75116 1/20 0.63
RPS6KA5 O75582 1/20 0.63
PRKD3 O94806 1/20 0.63
MAP4K4 O95819 1/20 0.63
PIM1 P11309 1/20 0.63
PHKG2 P15735 1/20 0.63
PRKACA P17612 1/20 0.63
RPS6KB1 P23443 1/20 0.63
CSNK1D P48730 1/20 0.63
CLK2 P49760 1/20 0.63
GSK3A P49840 1/20 0.63
PRKX P51817 1/20 0.63
PRKCZ Q05513 1/20 0.63
STK3 Q13188 1/20 0.63

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
SCHEMBL3579908 0.88 PARP1 (0.61) PKN1PKN2CHEK2PLK4MAPK13
SCHEMBL6840234 0.87 ALDH1A1 (0.52) PKN1PKN2CHEK2PLK4MAPK13
SCHEMBL2149454 0.86 PARP1 (0.63) PKN1PKN2CHEK2PLK4MAPK13
SCHEMBL6806964 0.85 PKN1 (0.65) PKN1PKN2CHEK2PLK4MAPK13
SCHEMBL6805689 0.85 PKN1 (0.49) PKN1PKN2CHEK2PLK4MAPK13
SCHEMBL6809910 0.85 PKN1 (0.46) PKN1PKN2CHEK2PLK4MAPK13
SCHEMBL7583436 0.84 PARP1 (0.66) PKN1PKN2CHEK2PLK4MAPK13
SCHEMBL3575391 0.81 DHODH (0.47) PKN1PKN2CHEK2PLK4MAPK13
SCHEMBL3585144 0.81 PARP1 (0.64) PLK4MAP4K4PIM1AURKBMKNK2
SCHEMBL6805361 0.81 PDPK1 (0.43) PKN1PKN2CHEK2PLK4MAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6696437-B1 Heterocyclically substituted benzimidazoles, the production and application thereof ABBOTT GMBH & CO. KG (DE) 2004-02-24 US disclosed