SCHEMBL14573293

SCHEMBL14573293

CNc1nccn2c(-c3ccc(NS(=O)(=O)CCN4CCCCC4)cc3)cnc12

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 14/20 0.44
▸ HRH3 Q9Y5N1 1/20 0.43
▸ AURKA O14965 2/20 0.42
▸ FLT3 P36888 2/20 0.41
▸ SRC P12931 1/20 0.39
▸ AURKB Q96GD4 1/20 0.38

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
SCHEMBL5618995 0.82 TTK (0.48) TTKFLT3
SCHEMBL14573294 0.81 TTK (0.50) TTKAURKAFLT3
SCHEMBL6366899 0.81 TTK (0.45) TTKAURKAFLT3AURKB
SCHEMBL5404932 0.80 TTK (0.56) TTK
SCHEMBL5618421 0.79 TTK (0.50) TTKAURKAFLT3AURKB
SCHEMBL5394669 0.79 TTK (0.54) TTK
SCHEMBL5618443 0.78 TTK (0.55) TTK
SCHEMBL5410621 0.77 TTK (0.57) TTK
SCHEMBL14573296 0.76 TTK (0.43) TTKAURKAFLT3
SCHEMBL14573297 0.76 TTK (0.43) TTKAURKAFLT3

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
US-7186832-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-03-06 — — US disclosed
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