SCHEMBL14530725

SCHEMBL14530725

COc1ccccc1Nc1nccn2c(C3=CN(C)NC3)cnc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.40
▸ YES1 P07947 1/20 0.40
▸ LCK P06239 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PKM P14618 2/20 0.39
▸ ALK Q9UM73 2/20 0.38
▸ CDK19 Q9BWU1 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TTK P33981 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ PTK2 Q05397 1/20 0.35
▸ AURKA O14965 3/20 0.35
▸ AURKB Q96GD4 2/20 0.35
▸ PDE4A P27815 1/20 0.35

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
SCHEMBL14529900 0.84 TTK (0.50) TTKAURKAAURKB
SCHEMBL8246957 0.79 AURKA (0.57) ABL1YES1ALKCDK19TTK
SCHEMBL14507206 0.79 TTK (0.41) LCKTTKAURKAAURKB
SCHEMBL14537080 0.77 AURKA (0.45) TTKAURKAAURKB
SCHEMBL14530729 0.77 AURKA (0.51) TTKAURKAAURKBEGFR
SCHEMBL15146186 0.75 FYN (0.49) TTKAURKAAURKBEGFR
SCHEMBL14530346 0.75 HTT (0.41) LCKMEN1KMT2ANPC1RAB9A
SCHEMBL14530155 0.73 AURKA (0.43) TTKAURKAAURKB
SCHEMBL14529891 0.72 TTK (0.34) TTK
SCHEMBL14536961 0.71 FLT3 (0.51) TTK

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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