SCHEMBL14530155

SCHEMBL14530155

Cc1nsc(Nc2nccn3c(C4=CN(C)NC4)cnc23)n1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 8/20 0.43
▸ AURKB Q96GD4 7/20 0.43
▸ FLT3 P36888 7/20 0.34
▸ CHEK1 O14757 1/20 0.31
▸ TTK P33981 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.30
▸ MAPKAPK5 Q8IW41 1/20 0.30

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
SCHEMBL8247201 0.79 AURKA (0.68) AURKAAURKBFLT3CHEK1TTK
SCHEMBL14537080 0.79 AURKA (0.45) AURKAAURKBFLT3TTKADORA3
SCHEMBL14529900 0.78 TTK (0.50) AURKAAURKBFLT3TTKMAPKAPK5
SCHEMBL14507206 0.75 TTK (0.41) AURKAAURKBFLT3TTKMAPKAPK5
SCHEMBL14530725 0.73 ABL1 (0.40) AURKAAURKBTTK
SCHEMBL15146186 0.71 FYN (0.49) AURKAAURKBFLT3TTKADORA3
SCHEMBL14536958 0.71 AURKA (0.36) AURKAAURKBFLT3TTKADORA3
SCHEMBL14536961 0.71 FLT3 (0.51) FLT3TTKADORA3
SCHEMBL14530729 0.71 AURKA (0.51) AURKAAURKBTTKMAPKAPK5
SCHEMBL14507243 0.70 EGFR (0.41) AURKAAURKBFLT3TTKMAPKAPK5

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-2007058873-A2 IMIDAZOPYRAZINES AS CYCLIN DEPENTEND KINASE INHIBITORS SCHERING CORPORATION (US) 2007-05-24 — — WO disclosed
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