SCHEMBL13821698

SCHEMBL13821698

CNC(=O)/C=C/c1c[nH]c2ncc(N)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP3K7 O43318 6/20 0.46
▸ TAB1 Q15750 6/20 0.46
▸ PLAU P00749 1/20 0.43
▸ CCNC P24863 5/20 0.38
▸ CDK8 P49336 5/20 0.38
▸ CDK19 Q9BWU1 1/20 0.38
▸ PLK4 O00444 3/20 0.36
▸ PRKD3 O94806 3/20 0.36
▸ MAP4K4 O95819 3/20 0.36
▸ LCK P06239 3/20 0.36
▸ FYN P06241 3/20 0.36
▸ CSF1R P07333 3/20 0.36
▸ LYN P07948 3/20 0.36
▸ FGFR1 P11362 3/20 0.36
▸ SRC P12931 3/20 0.36
▸ FLT1 P17948 3/20 0.36
▸ FGFR3 P22607 3/20 0.36
▸ RPS6KB1 P23443 3/20 0.36
▸ FLT4 P35916 3/20 0.36
▸ KDR P35968 3/20 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
SCHEMBL4348310 0.85 MAP3K7 (0.44) MAP3K7TAB1CCNCCDK8PLK4
SCHEMBL13821697 0.80 MAP3K7 (0.41) MAP3K7TAB1PLAUCCNCCDK8
SCHEMBL4352533 0.76 KMT2A (0.57) MAP3K7TAB1CCNCCDK8CDK19
SCHEMBL4352528 0.76 KMT2A (0.57) MAP3K7TAB1CCNCCDK8CDK19
SCHEMBL29953503 0.75 KMT2A (0.51) PLAUNTRK1AXLKITDYRK1A
SCHEMBL9906847 0.75 KMT2A (0.51) PLAUNTRK1AXLKITDYRK1A
SCHEMBL31318227 0.73 MAP4K1 (0.67) ITKABL1BTK
SCHEMBL13821349 0.73 ALDH1A1 (0.48) MAP3K7TAB1PLAUGSK3B
SCHEMBL24758308 0.72 TDO2 (0.43) MAP3K7TAB1PLAUAXL
SCHEMBL16945253 0.71 MAP3K7 (0.42) MAP3K7TAB1PLK4PRKD3LCK

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-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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