SCHEMBL25626635

SCHEMBL25626635

CCOC(=O)c1nn(CCO)c2c1CCc1cnc(Nc3cc(N4CCN(C)CC4)ccc3OCC(F)(F)F)nc1-2

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 19/20 0.73
▸ PLK3 Q9H4B4 9/20 0.73
▸ PLK2 Q9NYY3 6/20 0.73
▸ FLT3 P36888 5/20 0.73
▸ CSNK2A2 P19784 2/20 0.73
▸ MELK Q14680 2/20 0.73
▸ CSNK2B P67870 1/20 0.73
▸ CSNK2A1 P68400 1/20 0.73
▸ CSNK2A3 Q8NEV1 1/20 0.73
▸ CCNA2 P20248 3/20 0.64
▸ CDK2 P24941 3/20 0.64
▸ CCNA1 P78396 3/20 0.64
▸ NEK6 Q9HC98 3/20 0.60
▸ RPS6KA4 O75676 1/20 0.57
▸ CDK1 P06493 1/20 0.57
▸ KIT P10721 1/20 0.57
▸ IMPDH2 P12268 1/20 0.57
▸ CCNB1 P14635 1/20 0.57
▸ CCNE1 P24864 1/20 0.57
▸ FLT4 P35916 1/20 0.57

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
SCHEMBL3503569 0.93 PLK1 (0.85) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL25626646 0.92 PLK1 (0.86) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL25627127 0.87 PLK1 (0.77) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL25626155 0.87 PLK1 (0.85) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL25627189 0.87 PLK1 (0.86) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL25626843 0.86 PLK1 (0.77) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL25624956 0.85 PLK1 (0.73) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL30777923 0.85 PLK1 (0.88) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL13225438 0.85 PLK1 (0.88) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL3504604 0.85 PLK1 (0.84) PLK1PLK3PLK2FLT3CSNK2A2

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-2023104178-A1 PROTEIN KINASE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 山东绿叶制药有限公司 2023-06-15 — — WO disclosed
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