SCHEMBL14280002

SCHEMBL14280002

COc1cc(Nc2nc3cccc(-c4ccc(C)cc4)c3o2)ccc1C

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 8/20 0.66
JAK1 P23458 8/20 0.66
TYK2 P29597 6/20 0.65
JAK3 P52333 5/20 0.62
RPS6KA2 Q15349 12/20 0.61

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
SCHEMBL2569417 0.86 JAK2 (0.61) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL3614167 0.83 JAK2 (0.58) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL2569413 0.79 JAK2 (0.73) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL2573634 0.79 JAK2 (1.00) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL2573422 0.79 JAK2 (1.00) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL2571709 0.79 JAK2 (0.65) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL2572342 0.78 JAK2 (0.82) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL2571101 0.78 JAK2 (0.82) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL2569558 0.78 JAK2 (0.64) JAK2JAK1TYK2JAK3RPS6KA2
SCHEMBL2574543 0.77 JAK2 (0.79) JAK2JAK1TYK2JAK3RPS6KA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008031594-A1 BENZOXAZOLES AND OXAZOLOPYRIDINES BEING USEFUL AS JANUS KINASES INHIBITORS NOVARTIS AG (CH) 2008-03-20 WO disclosed