SCHEMBL6624979

SCHEMBL6624979

COC(=O)c1cccc2c1[nH]c1ccc3ccncc3c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.45
MAPK9 P45984 1/20 0.45
MAPK10 P53779 1/20 0.45
PKN1 Q16512 1/20 0.45
PKN2 Q16513 1/20 0.45
PIM1 P11309 3/20 0.41
PIM2 Q9P1W9 1/20 0.41
CDK5 Q00535 2/20 0.41
CDK5R1 Q15078 2/20 0.41
CLK1 P49759 1/20 0.41
CLK2 P49760 1/20 0.41
CLK3 P49761 1/20 0.41
DYRK1A Q13627 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
PIM3 Q86V86 3/20 0.41
MPL P40238 1/20 0.41
CDK4 P11802 1/20 0.40

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
SCHEMBL6625721 0.85 PBRM1 (0.48) PIM1PIM2CDK5CDK5R1CLK1
SCHEMBL6624281 0.80 PIM3 (0.42) PKN1PKN2PIM1DYRK1APIM3
SCHEMBL6624277 0.79 RAD52 (0.51) DYRK1AJAK2CSNK2A1
SCHEMBL2688190 0.78 PARP1 (0.56) MAPK8MAPK9MAPK10PKN1PKN2
SCHEMBL10136632 0.78 PARP1 (0.50) MAPK8MAPK9MAPK10PKN1PKN2
SCHEMBL21801215 0.77 MAPK8 (0.53) MAPK8MAPK9MAPK10PKN1PKN2
SCHEMBL29715210 0.77 MAPK8 (0.53) MAPK8MAPK9MAPK10PKN1PKN2
SCHEMBL6622666 0.75 LMNA (0.50) PIM1PIM3MPLJAK2KDM4E
SCHEMBL6629158 0.74 PIM3 (0.46) PIM1PIM3MPLCDK4CCND1
SCHEMBL8487413 0.73 JAK2 (0.52) PIM1PIM3MPLJAK2KDM4E

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-0831094-B1 FUSED POLYCYCLIC HETEROCYCLE DERIVATIVES EISAI CO LTD (JP) 2004-12-08 EP disclosed
EP-0831094-A1 FUSED POLYCYCLIC HETEROCYCLE DERIVATIVES Eisai Co., Ltd. (JP) 1998-03-25 EP disclosed