SCHEMBL14537009

SCHEMBL14537009

Nn1cc(-c2cnc3c(NC4CC4)nccn23)cn1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 7/20 0.46
▸ ADORA3 P0DMS8 3/20 0.45
▸ AURKA O14965 4/20 0.44
▸ AURKB Q96GD4 4/20 0.44
▸ TTK P33981 6/20 0.43

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
SCHEMBL14529893 0.94 ADORA3 (0.48) FLT3ADORA3AURKAAURKBTTK
SCHEMBL13954859 0.92 FLT3 (0.47) FLT3ADORA3AURKAAURKBTTK
SCHEMBL14530017 0.92 FLT3 (0.56) FLT3ADORA3AURKAAURKBTTK
SCHEMBL8240135 0.86 AURKA (0.58) FLT3ADORA3AURKAAURKBTTK
SCHEMBL14537008 0.83 AURKA (0.46) FLT3AURKAAURKBTTK
SCHEMBL8246210 0.81 AURKA (0.55) FLT3ADORA3AURKAAURKBTTK
SCHEMBL5394350 0.80 TTK (0.55) FLT3ADORA3TTK
SCHEMBL5394394 0.80 TTK (0.59) FLT3ADORA3TTK
SCHEMBL8241005 0.79 AURKA (0.64) FLT3ADORA3AURKAAURKBTTK
SCHEMBL8240563 0.79 AURKA (0.53) FLT3AURKAAURKBTTK

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
WO-2007056468-A1 METHODS FOR INHIBITING PROTEIN KINASES SCHERING CORPORATION (US) 2007-05-18 — — WO disclosed
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