SCHEMBL16405244

SCHEMBL16405244

CC(C1CC1)N1CC(=O)N(C)c2cnc(-c3cn[nH]c3-c3nccs3)nc21

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 7/20 0.60
PLK2 Q9NYY3 7/20 0.60
PLK3 Q9H4B4 1/20 0.60
PIK3CG P48736 3/20 0.32

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
SCHEMBL6844664 0.83 PLK1 (0.52) PLK1PLK2PLK3PIK3CG
SCHEMBL2050146 0.82 PLK1 (0.83) PLK1PLK2PLK3
SCHEMBL16405241 0.79 PLK1 (0.55) PLK1PLK2PLK3
SCHEMBL6844854 0.77 PLK1 (0.53) PLK1PLK2PLK3
SCHEMBL6844454 0.73 PLK1 (0.44) PLK1PLK2PLK3
SCHEMBL2051031 0.73 PLK2 (0.78) PLK1PLK2PLK3
SCHEMBL2051036 0.73 PLK2 (0.78) PLK1PLK2PLK3
SCHEMBL2052265 0.73 PLK1 (0.58) PLK1PLK2PLK3
SCHEMBL6844528 0.72 PLK1 (0.43) PLK1PLK2PLK3
SCHEMBL1288358 0.72 PLK1 (0.58) PLK1PLK2PLK3

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
EP-2516441-B1 PTERIDINONES AS INHIBITORS OF POLO-LIKE KINASE ELAN PHARM INC (US) 2015-01-21 EP disclosed