SCHEMBL4350414

SCHEMBL4350414

CC(C)C(=O)Nc1cnc2[nH]cc(/C=C/C(N)=O)c2c1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAP3K7 O43318 14/20 0.46
▸ TAB1 Q15750 14/20 0.46
▸ BTK Q06187 4/20 0.37
▸ CIT O14578 1/20 0.36
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL4350420 1.00 MAP3K7 (0.46) MAP3K7TAB1BTKCITKMT2A
SCHEMBL4346952 0.87 MAP3K7 (0.43) MAP3K7TAB1BTK
SCHEMBL4346955 0.87 MAP3K7 (0.43) MAP3K7TAB1BTK
SCHEMBL16932989 0.86 MAP3K7 (0.47) MAP3K7TAB1BTK
SCHEMBL16932988 0.86 MAP3K7 (0.47) MAP3K7TAB1BTK
SCHEMBL4346854 0.85 MAP3K7 (0.47) MAP3K7TAB1BTK
SCHEMBL4346848 0.85 MAP3K7 (0.47) MAP3K7TAB1BTK
SCHEMBL13821438 0.81 MAP3K7 (0.41) MAP3K7TAB1BTK
SCHEMBL4346683 0.80 GSK3B (0.49) BTK
SCHEMBL4346687 0.80 GSK3B (0.49) BTK

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 3 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
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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