SCHEMBL3262458

SCHEMBL3262458

Nc1ccc(Nc2nc3c(Br)cccn3n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.51
JAK3 P52333 18/20 0.51
PTK2 Q05397 12/20 0.51
AHR P35869 1/20 0.43

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
SCHEMBL2634414 0.82 JAK2 (0.64) JAK2JAK3PTK2
SCHEMBL13535843 0.81 JAK2 (0.62) JAK2JAK3PTK2
SCHEMBL13535688 0.80 JAK2 (0.50) JAK2JAK3PTK2
SCHEMBL3261327 0.80 JAK2 (0.50) JAK2JAK3PTK2
SCHEMBL3259962 0.80 JAK2 (0.52) JAK2JAK3PTK2
SCHEMBL13536037 0.80 JAK2 (0.49) JAK2JAK3PTK2
SCHEMBL13535593 0.80 JAK2 (0.77) JAK2JAK3PTK2
SCHEMBL3263162 0.80 JAK2 (0.53) JAK2JAK3PTK2
SCHEMBL31557534 0.78 JAK2 (0.55) JAK2JAK3PTK2AHR
SCHEMBL13535764 0.78 JAK2 (0.44) JAK2JAK3PTK2AHR

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-2010010184-A1 [1, 2, 4] TRIAZOLO [1, 5-A] PYRIDINES AS JAK INHIBITORS GALAPAGOS NV (BE) 2010-01-28 WO disclosed
WO-2010010184-A1 [1, 2, 4] TRIAZOLO [1, 5-A] PYRIDINES AS JAK INHIBITORS GALAPAGOS NV (BE) 2010-01-28 WO disclosed