SCHEMBL4690264

SCHEMBL4690264

c1csc(CNc2ccc3ncc(-c4cncnc4)n3n2)c1

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FYN P06241 18/20 0.81
MKNK1 Q9BUB5 1/20 0.57
KDM4E B2RXH2 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL2945214 0.89 FYN (1.00) FYNMKNK1
SCHEMBL2945086 0.89 FYN (0.81) FYNMKNK1
SCHEMBL1055715 0.86 FYN (0.81) FYNMKNK1
SCHEMBL1053098 0.86 FYN (0.77) FYNMKNK1KDM4ENPC1RAB9A
SCHEMBL2949134 0.85 FYN (1.00) FYNMKNK1
SCHEMBL2944110 0.85 FYN (0.79) FYNMKNK1
SCHEMBL1055683 0.85 FYN (1.00) FYNMKNK1
SCHEMBL2943456 0.84 FYN (1.00) FYNMKNK1
SCHEMBL2942433 0.83 FYN (0.81) FYN
SCHEMBL30521834 0.83 FYN (1.00) FYNMKNK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1900739-A1 Diazolodiazine derivatives as kinase inhibitors CELLZOME AG (DE) 2008-03-19 EP claimed
WO-2008025822-A1 DIAZOLODIAZINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2008-03-06 WO claimed
EP-1900739-A1 Diazolodiazine derivatives as kinase inhibitors CELLZOME AG (DE) 2008-03-19 EP disclosed
WO-2008025822-A1 DIAZOLODIAZINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2008-03-06 WO disclosed