SCHEMBL15005797

SCHEMBL15005797

NC(=O)Oc1c(-c2ccncc2)[nH]c2c1ccc1cnccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 7/20 0.39
▸ CDK5 Q00535 3/20 0.38
▸ DYRK1A Q13627 3/20 0.38
▸ CLK1 P49759 2/20 0.38
▸ CDK5R1 Q15078 2/20 0.38
▸ CLK2 P49760 2/20 0.36
▸ CLK3 P49761 1/20 0.36
▸ CLK4 Q9HAZ1 1/20 0.36
▸ DYRK1B Q9Y463 1/20 0.36
▸ MAPK12 P53778 4/20 0.36
▸ CDK2 P24941 2/20 0.36
▸ CSNK1D P48730 2/20 0.36
▸ AURKA O14965 1/20 0.36
▸ DAPK3 O43293 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ ROCK2 O75116 1/20 0.36
▸ CHEK2 O96017 1/20 0.36
▸ CDK1 P06493 1/20 0.36
▸ PIM1 P11309 1/20 0.36
▸ FGFR1 P11362 1/20 0.36

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
SCHEMBL15005624 0.93 MAP2 (0.42) CDC7CDK5DYRK1ACLK1CDK5R1
SCHEMBL15005240 0.91 CDC7 (0.40) CDC7CDK5DYRK1ACLK1CDK5R1
SCHEMBL3590152 0.82 CDC7 (0.43) CDC7CDK5DYRK1ACLK1CDK5R1
SCHEMBL15005727 0.80 CDC7 (0.37) CDC7CDK5DYRK1ACLK1CDK5R1
SCHEMBL3603414 0.78 CDC7 (0.43) CDC7CDK5DYRK1ACLK2MAPK12
SCHEMBL3597459 0.75 MAP2 (0.48) CDC7CDK5DYRK1ACLK1CDK5R1
SCHEMBL3594823 0.73 CDC7 (0.45) CDC7CDK5DYRK1ACLK1CDK5R1
SCHEMBL3602492 0.73 ERN1 (0.49) CDC7CDK5DYRK1AMAPK12CDK2
SCHEMBL15005688 0.72 ROCK2 (0.36) CLK4ROCK2PRKACAMAPK1AKT1
SCHEMBL3608210 0.72 DHODH (0.44) CDC7CDK5DYRK1AMAPK12CDK2

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-2118102-B1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES NERVIANO MEDICAL SCIENCES SRL (IT) 2013-06-12 — — EP claimed
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