SCHEMBL4783698

SCHEMBL4783698

CCN1C(=O)N(C)c2cnc(Nc3cc(F)c(C(=O)NCCN4CCCC4)cc3F)nc2N1C1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 18/20 0.56
PLK3 Q9H4B4 16/20 0.56
PLK2 Q9NYY3 15/20 0.56
BRD4 O60885 1/20 0.45
ALK Q9UM73 1/20 0.41

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
SCHEMBL4783441 0.93 PLK1 (0.62) PLK1PLK3PLK2BRD4
SCHEMBL4849016 0.89 PLK1 (0.53) PLK1PLK3PLK2BRD4ALK
SCHEMBL4794798 0.88 PLK1 (0.64) PLK1PLK3PLK2BRD4ALK
SCHEMBL4783982 0.86 PLK1 (0.65) PLK1PLK3PLK2BRD4ALK
SCHEMBL4782269 0.85 PLK1 (0.58) PLK1PLK3PLK2BRD4
SCHEMBL3547907 0.85 PLK1 (0.56) PLK1PLK3PLK2BRD4ALK
SCHEMBL3546812 0.85 PLK1 (0.55) PLK1PLK3PLK2BRD4ALK
SCHEMBL4782053 0.83 PLK1 (0.65) PLK1PLK3PLK2BRD4ALK
SCHEMBL4784347 0.83 PLK1 (0.79) PLK1PLK3PLK2BRD4ALK
SCHEMBL3545536 0.83 PLK1 (0.57) PLK1PLK3PLK2BRD4

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-2008040951-A1 COMPOUNDS ASTRAZENECA AB (SE) 2008-04-10 WO disclosed