SCHEMBL14530730

SCHEMBL14530730

CC(C)(C)OC(=O)NC1Cc2ccc(Nc3nccn4c(-c5cn[nH]c5)cnc34)cc2C1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 16/20 0.54
▸ AURKB Q96GD4 10/20 0.49
▸ AURKA O14965 2/20 0.49
▸ MAPKAPK5 Q8IW41 1/20 0.47
▸ TTK P33981 1/20 0.42
▸ LCK P06239 7/20 0.42

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
SCHEMBL8247827 0.87 AURKA (0.53) PTK6AURKBAURKAMAPKAPK5TTK
SCHEMBL13954839 0.83 PTK6 (0.55) PTK6AURKBAURKAMAPKAPK5TTK
SCHEMBL8426671 0.78 BRD4 (0.39) PTK6AURKATTKLCK
SCHEMBL5575570 0.77 MAPKAPK5 (0.58) PTK6AURKBAURKAMAPKAPK5TTK
SCHEMBL14538354 0.76 PTK6 (0.52) PTK6AURKBAURKAMAPKAPK5TTK
SCHEMBL14530726 0.73 PTK6 (0.56) PTK6AURKBAURKAMAPKAPK5TTK
SCHEMBL14537083 0.73 PTK6 (0.56) PTK6AURKBAURKAMAPKAPK5LCK
SCHEMBL14530402 0.72 MAPKAPK5 (0.58) PTK6AURKBAURKAMAPKAPK5TTK
SCHEMBL1674322 0.71 MAPKAPK5 (0.63) PTK6AURKBAURKAMAPKAPK5TTK
SCHEMBL14536960 0.71 MAPKAPK5 (0.62) PTK6AURKBAURKAMAPKAPK5TTK

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