SCHEMBL24924

SCHEMBL24924

COc1ccc(Nc2nc3cccc(-c4cccnc4)n3n2)cc1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 12/20 0.67
JAK1 P23458 7/20 0.67
JAK3 P52333 6/20 0.66
PTK2 Q05397 4/20 0.66
TYK2 P29597 2/20 0.51
IKBKB O14920 1/20 0.51
RIPK2 O43353 1/20 0.51
LCK P06239 1/20 0.51
SYK P43405 1/20 0.51
GSK3B P49841 1/20 0.51
PTK2B Q14289 1/20 0.51
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
PLK1 P53350 1/20 0.47

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
SCHEMBL2228200 0.95 JAK2 (0.69) JAK2JAK1JAK3PTK2TYK2
SCHEMBL7977613 0.89 JAK2 (0.69) JAK2JAK1JAK3PTK2TYK2
SCHEMBL7974880 0.86 JAK2 (0.74) JAK2JAK1JAK3PTK2TYK2
SCHEMBL2144298 0.86 JAK2 (0.55) JAK2JAK1JAK3PTK2TYK2
SCHEMBL13072885 0.84 JAK2 (0.76) JAK2JAK1JAK3PTK2TYK2
SCHEMBL7975705 0.84 JAK2 (0.76) JAK2JAK1JAK3PTK2TYK2
SCHEMBL13033022 0.83 JAK2 (0.79) JAK2JAK1JAK3PTK2TYK2
SCHEMBL7963261 0.83 JAK2 (0.71) JAK2JAK1JAK3PTK2TYK2
SCHEMBL13276297 0.83 JAK2 (0.66) JAK2JAK1JAK3PTK2TYK2
SCHEMBL13072782 0.83 JAK2 (0.74) JAK2JAK1JAK3PTK2TYK2

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
EP-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP disclosed
WO-2012025186-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO disclosed