SCHEMBL8205463

SCHEMBL8205463

CCOC(=O)c1cc2c3c(ccc2[nH]1)NCC3

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.60
PLK4 O00444 1/20 0.60
DAPK3 O43293 1/20 0.60
DYRK3 O43781 1/20 0.60
JAK2 O60674 1/20 0.60
PRKD3 O94806 1/20 0.60
MAP4K4 O95819 1/20 0.60
PIM1 P11309 1/20 0.60
RPS6KB1 P23443 1/20 0.60
CDK2 P24941 1/20 0.60
KDR P35968 1/20 0.60
MAPK8 P45983 1/20 0.60
CLK2 P49760 1/20 0.60
GSK3B P49841 1/20 0.60
CDK5 Q00535 1/20 0.60
DYRK1A Q13627 1/20 0.60
PIM3 Q86V86 1/20 0.60
MINK1 Q8N4C8 1/20 0.60
AURKB Q96GD4 1/20 0.60
PBK Q96KB5 1/20 0.60

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
SCHEMBL533320 0.86 KDM4E (0.46) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL22062297 0.83 PLK4 (0.46) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL22048826 0.81 MAPT (0.46) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL124755 0.80 KDM4E (0.48) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL889790 0.79 PLK4 (0.41) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL3420814 0.79 HTR1A (0.45) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL11745635 0.79 RAB9A (0.59) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL11747833 0.79 RAB9A (0.56) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL31221504 0.78 MAPK1 (0.49) MAPK1PLK4DAPK3DYRK3JAK2
SCHEMBL532379 0.77 MAPT (0.46) MAPK1PLK4DAPK3DYRK3JAK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0359454-B1 CC-1065 analogs having two CPI subunits UPJOHN CO (US) 2000-12-27 EP disclosed
EP-0359454-A1 Novel CC-1065 analogs having two CPI subunits THE UPJOHN COMPANY (US) 1990-03-21 EP disclosed