SCHEMBL4348310

SCHEMBL4348310

NC(=O)C=Cc1c[nH]c2ncc(N)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP3K7 O43318 12/20 0.44
▸ TAB1 Q15750 12/20 0.44
▸ CCNC P24863 1/20 0.36
▸ CDK8 P49336 1/20 0.36
▸ MAP3K11 Q16584 1/20 0.36
▸ DYRK1A Q13627 3/20 0.34
▸ CLK1 P49759 2/20 0.34
▸ DYRK2 Q92630 2/20 0.34
▸ DYRK1B Q9Y463 2/20 0.34
▸ TDO2 P48775 1/20 0.34
▸ NTRK1 P04629 2/20 0.34
▸ CDC7 O00311 1/20 0.34
▸ PLK4 O00444 1/20 0.34
▸ CHEK1 O14757 1/20 0.34
▸ AURKA O14965 1/20 0.34
▸ MAPK13 O15264 1/20 0.34
▸ PDPK1 O15530 1/20 0.34
▸ DYRK3 O43781 1/20 0.34
▸ ROCK2 O75116 1/20 0.34
▸ RPS6KA5 O75582 1/20 0.34

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
SCHEMBL13821698 0.85 MAP3K7 (0.46) MAP3K7TAB1CCNCCDK8DYRK1A
SCHEMBL24197757 0.84 MAP3K7 (0.46) MAP3K7TAB1CCNCCDK8DYRK1A
SCHEMBL16945239 0.83 MAP3K7 (0.44) MAP3K7TAB1AXLGSK3B
SCHEMBL18238563 0.83 MAP3K7 (0.44) MAP3K7TAB1AXLGSK3B
SCHEMBL16945253 0.82 MAP3K7 (0.42) MAP3K7TAB1MAP3K11DYRK1ACLK1
SCHEMBL4346955 0.80 MAP3K7 (0.43) MAP3K7TAB1DYRK1ACLK1DYRK2
SCHEMBL16932960 0.80 GSK3B (0.56) MAP3K7TAB1CDK8DYRK1ANTRK1
SCHEMBL16932959 0.80 GSK3B (0.56) MAP3K7TAB1CDK8DYRK1ANTRK1
SCHEMBL16945190 0.80 NEK1 (0.44) MAP3K7TAB1MAP3K11DYRK1ACLK1
SCHEMBL4346952 0.80 MAP3K7 (0.43) MAP3K7TAB1DYRK1ACLK1DYRK2

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-2070928-A1 7-azaindol-3-ylacrylamides active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2009-06-17 — — EP claimed
EP-2070928-A1 7-azaindol-3-ylacrylamides active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2009-06-17 — — EP disclosed
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