SCHEMBL4783471

SCHEMBL4783471

CCN1C(=O)N(C)c2cnc(Nc3ccc(N4CCOCC4)c(Cl)c3)nc2N1C1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 3/20 0.51
PLK3 Q9H4B4 2/20 0.51
SYK P43405 2/20 0.48
CDK4 P11802 3/20 0.47
CCND1 P24385 3/20 0.47
CCND2 P30279 3/20 0.47
CCND3 P30281 3/20 0.47
ALK Q9UM73 4/20 0.45
MAPK9 P45984 3/20 0.45
JAK2 O60674 3/20 0.45
PAK4 O96013 3/20 0.45
ABL1 P00519 3/20 0.45
RET P07949 3/20 0.45
LTK P29376 3/20 0.45
MAPK8 P45983 3/20 0.45
MAP2K1 Q02750 3/20 0.45
MST1R Q04912 3/20 0.45
PTK2 Q05397 3/20 0.45
MAP4K2 Q12851 3/20 0.45
ROCK1 Q13464 3/20 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
SCHEMBL4781952 0.89 CDK4 (0.53) PLK1PLK3CDK4CCND1CCND2
SCHEMBL4844864 0.86 PLK1 (0.52) PLK1PLK3CDK4CCND1CCND2
SCHEMBL14221236 0.85 PLK1 (0.55) PLK1PLK3CDK4CCND1CCND2
SCHEMBL4781914 0.84 PLK1 (0.52) PLK1PLK3CDK4CCND1CCND3
SCHEMBL4729262 0.83 PLK1 (0.56) PLK1PLK3PIP4K2APIP4K2BBRD4
SCHEMBL4781788 0.83 PLK1 (0.60) PLK1PLK3ALKPTK2MAP4K4
SCHEMBL14220956 0.82 PLK1 (0.56) PLK1PLK3SYKCDK4CCND1
SCHEMBL4730395 0.82 PLK1 (0.54) PLK1PLK3CSF1RPIP4K2APIP4K2B
SCHEMBL4782049 0.82 PLK1 (0.55) PLK1PLK3AURKBPIP4K2APIP4K2B
SCHEMBL4779878 0.82 PLK1 (0.54) PLK1PLK3PIP4K2APIP4K2BBRD4

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