SCHEMBL14536997

SCHEMBL14536997

CCN(CC)S(=O)(=O)c1sc(Nc2nc(C3=CCCNC3)cn3c(-c4coc(N)c4)cnc23)cc1C

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 6/20 0.49
▸ PTK6 Q13882 3/20 0.33
▸ AURKB Q96GD4 13/20 0.33
▸ AURKA O14965 5/20 0.33
▸ RPS6KA3 P51812 4/20 0.33
▸ FLT3 P36888 2/20 0.33
▸ EPHB4 P54760 2/20 0.33
▸ LCK P06239 4/20 0.32
▸ IRAK4 Q9NWZ3 4/20 0.32
▸ KDR P35968 2/20 0.31

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
SCHEMBL12471021 0.90 CHEK1 (0.48) CHEK1PTK6AURKBAURKARPS6KA3
SCHEMBL12473197 0.88 CHEK1 (0.65) CHEK1PTK6AURKBAURKARPS6KA3
SCHEMBL13955028 0.88 CHEK1 (0.52) CHEK1PTK6AURKBAURKARPS6KA3
SCHEMBL14538479 0.83 PTK6 (0.33) CHEK1PTK6AURKBAURKARPS6KA3
SCHEMBL13955033 0.83 CHEK1 (0.51) CHEK1PTK6AURKBAURKARPS6KA3
SCHEMBL14536996 0.80 CHEK1 (0.75) CHEK1PTK6AURKBAURKARPS6KA3
SCHEMBL12473155 0.80 CHEK1 (0.68) CHEK1PTK6AURKBAURKARPS6KA3
SCHEMBL12473566 0.78 CHEK1 (0.70) CHEK1PTK6AURKBAURKALCK
SCHEMBL14538388 0.78 CHEK1 (0.56) CHEK1PTK6AURKBAURKARPS6KA3
SCHEMBL12473060 0.78 CHEK1 (0.66) CHEK1PTK6AURKBAURKARPS6KA3

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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