SCHEMBL4690288

SCHEMBL4690288

CN(C)CCNc1ccc2ncc(-c3ccccc3F)n2n1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 6/20 0.72
IKBKB O14920 8/20 0.51
FYN P06241 7/20 0.49

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
SCHEMBL19466738 0.88 MKNK1 (0.66) MKNK1IKBKBFYN
SCHEMBL16331673 0.84 MKNK1 (0.72) MKNK1FYN
SCHEMBL2948860 0.81 FYN (0.71) MKNK1IKBKBFYN
SCHEMBL19466740 0.79 MKNK1 (0.64) MKNK1FYN
SCHEMBL2948850 0.78 MKNK1 (0.67) MKNK1IKBKBFYN
SCHEMBL3036460 0.78 FYN (0.76) MKNK1IKBKBFYN
SCHEMBL2947844 0.78 IKBKB (0.58) MKNK1IKBKBFYN
SCHEMBL2951003 0.77 FYN (0.71) MKNK1FYN
SCHEMBL4691104 0.77 FYN (0.74) MKNK1IKBKBFYN
SCHEMBL3453200 0.76 MKNK1 (0.56) MKNK1IKBKBFYN

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