SCHEMBL6806535

SCHEMBL6806535

NC(=O)c1cccc2[nH]c(-c3cnccc3OCc3ccccc3)nc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.56
PARP1 P09874 14/20 0.55
PKN1 Q16512 3/20 0.55
PKN2 Q16513 3/20 0.55
CHEK2 O96017 2/20 0.55
PLK4 O00444 1/20 0.55
MAPK13 O15264 1/20 0.55
DYRK3 O43781 1/20 0.55
ROCK2 O75116 1/20 0.55
RPS6KA5 O75582 1/20 0.55
PRKD3 O94806 1/20 0.55
MAP4K4 O95819 1/20 0.55
PIM1 P11309 1/20 0.55
PHKG2 P15735 1/20 0.55
PRKACA P17612 1/20 0.55
RPS6KB1 P23443 1/20 0.55
CSNK1D P48730 1/20 0.55
CLK2 P49760 1/20 0.55
GSK3A P49840 1/20 0.55
PRKX P51817 1/20 0.55

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
SCHEMBL6588724 0.87 PDE5A (0.51) DHODHPARP1PKN1PKN2CHEK2
SCHEMBL6806538 0.84 PTGER1 (0.41) DHODHPARP1CHEK2
SCHEMBL6802857 0.83 AURKB (0.59) DHODHPARP1PKN1PKN2CHEK2
SCHEMBL6806133 0.83 PARP1 (0.75) DHODHPARP1PKN1PKN2CHEK2
SCHEMBL6806120 0.83 AURKB (0.58) DHODHPARP1PKN1PKN2CHEK2
SCHEMBL6805372 0.82 PKN2 (0.63) DHODHPARP1PKN1PKN2CHEK2
SCHEMBL6806556 0.82 PKN2 (0.57) DHODHPARP1PKN1PKN2CHEK2
SCHEMBL6810110 0.81 PIM1 (0.66) DHODHPARP1PKN1PKN2CHEK2
SCHEMBL6806298 0.80 PARP1 (0.65) DHODHPARP1PKN1PKN2CHEK2
SCHEMBL6809854 0.80 PIM1 (0.60) DHODHPARP1PKN1PKN2CHEK2

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