SCHEMBL14538353

SCHEMBL14538353

CN1C=C(c2cnc3c(NCC4CCNCC4)nccn23)CN1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 11/20 0.46
▸ ADORA3 P0DMS8 4/20 0.44
▸ FLT3 P36888 2/20 0.42
▸ AURKA O14965 1/20 0.41
▸ AURKB Q96GD4 1/20 0.41
▸ IRAK4 Q9NWZ3 1/20 0.38
▸ BRD4 O60885 1/20 0.37
▸ ATAD2 Q6PL18 1/20 0.37

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
SCHEMBL8246569 0.80 AURKA (0.61) TTKADORA3FLT3AURKAAURKB
SCHEMBL14536961 0.75 FLT3 (0.51) TTKADORA3FLT3
SCHEMBL8240997 0.75 AURKB (0.57) TTKAURKAAURKBIRAK4
SCHEMBL14529900 0.73 TTK (0.50) TTKFLT3AURKAAURKB
SCHEMBL14530388 0.73 ADORA3 (0.48) TTKADORA3FLT3AURKAAURKB
SCHEMBL14537080 0.71 AURKA (0.45) TTKADORA3FLT3AURKAAURKB
SCHEMBL14507206 0.71 TTK (0.41) TTKFLT3AURKAAURKB
SCHEMBL11940635 0.70 ADORA3 (0.56) TTKADORA3
SCHEMBL14529892 0.70 TTK (0.47) TTKADORA3AURKAAURKBIRAK4
SCHEMBL14530155 0.69 AURKA (0.43) TTKADORA3FLT3AURKAAURKB

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-2007058942-A2 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2007-05-24 — — WO disclosed
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