SCHEMBL4234657

SCHEMBL4234657

CCOc1c(-c2ncco2)c2nc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)ncc2n(C)c1=O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 5/20 0.54
IGF1R P08069 8/20 0.52
AURKA O14965 1/20 0.52
AURKB Q96GD4 1/20 0.52
PLK1 P53350 5/20 0.52
BRD4 O60885 3/20 0.52
LRRK2 Q5S007 1/20 0.51
PLK3 Q9H4B4 1/20 0.51

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
SCHEMBL4242288 0.87 IGF1R (0.54) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4380887 0.86 IGF1R (0.63) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4238685 0.86 IGF1R (0.57) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4240068 0.84 PTK2 (0.55) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4240072 0.84 PTK2 (0.55) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4238619 0.84 BRD4 (0.55) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4240316 0.83 BRD4 (0.55) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4243514 0.82 BRD4 (0.55) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4234673 0.82 PTK2 (0.56) PTK2IGF1RAURKAAURKBPLK1
SCHEMBL4236731 0.82 IGF1R (0.61) PTK2IGF1RAURKAAURKBBRD4

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