SCHEMBL3264165

SCHEMBL3264165

CC[C@@H]1c2c(C#N)ncn2-c2cnc(Nc3cc(F)c(C(=O)NC4CCN(C5CCNCC5)[C@H](CC(C)C)C4)cc3OC)nc2N1C1CCCC1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 20/20 0.74
PLK3 Q9H4B4 5/20 0.50
PLK2 Q9NYY3 5/20 0.50
BRD4 O60885 1/20 0.45

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
SCHEMBL3259963 0.95 PLK1 (0.78) PLK1PLK3PLK2
SCHEMBL3261587 0.93 PLK1 (0.75) PLK1PLK3PLK2
SCHEMBL3265448 0.93 PLK1 (0.75) PLK1PLK3PLK2BRD4
SCHEMBL3259082 0.91 PLK1 (0.74) PLK1PLK3PLK2BRD4
SCHEMBL3265579 0.89 PLK1 (0.77) PLK1PLK3PLK2BRD4
SCHEMBL3260121 0.87 PLK1 (0.74) PLK1PLK3PLK2BRD4
SCHEMBL3264163 0.84 PLK1 (0.81) PLK1PLK3PLK2BRD4
SCHEMBL3261508 0.84 PLK1 (0.75) PLK1PLK3PLK2BRD4
SCHEMBL3261988 0.83 PLK1 (0.74) PLK1PLK3PLK2BRD4
SCHEMBL13434809 0.83 PLK1 (0.79) PLK1PLK3PLK2

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
WO-2010025073-A1 DIHYDROIMIDAZO [ 1, 5-F] PTERIDINES AS POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-04 WO disclosed