SCHEMBL14536767

SCHEMBL14536767

CNc1sc(Nc2nc(CCNC(=O)OCc3ccccc3)cn3c(-c4cnn(C)c4)cnc23)cc1C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 2/20 0.40
▸ AURKB Q96GD4 16/20 0.40
▸ AURKA O14965 12/20 0.40
▸ PTK6 Q13882 1/20 0.38
▸ CHEK1 O14757 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ FLT3 P36888 1/20 0.38
▸ RPS6KA3 P51812 1/20 0.38
▸ EPHB4 P54760 1/20 0.38
▸ FGFR1 P11362 1/20 0.38
▸ FGFR3 P22607 1/20 0.38

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
SCHEMBL14536800 0.93 AURKB (0.39) TTKAURKBAURKAPTK6CHEK1
SCHEMBL14507633 0.90 TTK (0.40) TTKAURKBAURKAPTK6CHEK1
SCHEMBL14507631 0.89 TTK (0.39) TTKAURKBAURKAPTK6LCK
SCHEMBL14507635 0.89 PTK6 (0.41) TTKAURKBAURKAPTK6
SCHEMBL14507639 0.89 TTK (0.40) TTKAURKBAURKAPTK6FGFR1
SCHEMBL14508090 0.88 TTK (0.40) TTKAURKBAURKAPTK6FGFR1
SCHEMBL14507603 0.86 AURKB (0.39) TTKAURKBAURKAPTK6
SCHEMBL14507581 0.85 AURKB (0.53) AURKBAURKACHEK1RPS6KA3
SCHEMBL14507582 0.84 AURKB (0.43) AURKBAURKACHEK1LCKFLT3
SCHEMBL14507591 0.84 ANPEP (0.41) TTKAURKBAURKAPTK6FGFR1

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