SCHEMBL4234754

SCHEMBL4234754

C#Cc1c(OC)c(=O)n(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)nc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.59
AURKA O14965 1/20 0.57
AURKB Q96GD4 1/20 0.57
BRD4 O60885 11/20 0.56
PLK1 P53350 10/20 0.56
BRDT Q58F21 7/20 0.56
DCLK1 O15075 2/20 0.55
MAPK7 Q13164 2/20 0.55
PTK2 Q05397 4/20 0.54
DAPK3 O43293 2/20 0.54
PRKD3 O94806 2/20 0.54
CHEK2 O96017 2/20 0.54
EGFR P00533 2/20 0.54
FES P07332 2/20 0.54
PHKG2 P15735 2/20 0.54
CSNK1D P48730 2/20 0.54
CLK2 P49760 2/20 0.54
NEK2 P51955 2/20 0.54
CAMK2B Q13554 2/20 0.54
CAMK2G Q13555 2/20 0.54

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
SCHEMBL4240691 0.89 BRD4 (0.64) LRRK2AURKAAURKBBRD4PLK1
SCHEMBL4242620 0.88 AURKA (0.59) LRRK2AURKAAURKBBRD4PLK1
SCHEMBL4234396 0.87 BRD4 (0.59) LRRK2AURKAAURKBBRD4PLK1
SCHEMBL4234274 0.87 AURKA (0.59) LRRK2AURKAAURKBBRD4PLK1
SCHEMBL4240930 0.87 AURKA (0.61) LRRK2AURKAAURKBBRD4PLK1
SCHEMBL4238706 0.87 AURKA (0.57) LRRK2AURKAAURKBBRD4PLK1
SCHEMBL4238700 0.87 AURKA (0.57) LRRK2AURKAAURKBBRD4PLK1
SCHEMBL4236731 0.86 IGF1R (0.61) LRRK2AURKAAURKBBRD4DCLK1
SCHEMBL4238681 0.85 AURKA (0.56) LRRK2AURKAAURKBBRD4PLK1
SCHEMBL4226614 0.85 IGF1R (0.60) LRRK2AURKAAURKBBRD4PLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009112524-A1 PYRIDOPYRIMIDINES AS PLK1 ( POLO-LIKE KINASE) INHIBITORS 4SC AG (DE) 2009-09-17 WO disclosed
EP-2100894-A1 Pyridopyrimidines used as Plk1 (polo-like kinase) inhibitors 4SC AG (DE) 2009-09-16 EP disclosed