SCHEMBL13535655

SCHEMBL13535655

Fc1cc(-c2cccn3nc(Nc4ccc(Cl)nc4)nc23)ccc1CN1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 19/20 0.55
▸ JAK3 P52333 18/20 0.55
▸ PTK2 Q05397 16/20 0.55
▸ JAK1 P23458 2/20 0.45
▸ TYK2 P29597 1/20 0.42

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
SCHEMBL13535628 0.87 JAK2 (0.58) JAK2JAK3PTK2JAK1
SCHEMBL13535686 0.83 JAK2 (0.56) JAK2JAK3PTK2JAK1
SCHEMBL13535594 0.83 JAK2 (0.77) JAK2JAK3PTK2JAK1
SCHEMBL13536175 0.83 JAK2 (0.49) JAK2JAK3PTK2JAK1
SCHEMBL13535986 0.82 JAK2 (0.56) JAK2JAK3PTK2JAK1
SCHEMBL13536106 0.82 JAK2 (0.54) JAK2JAK3PTK2JAK1
SCHEMBL13535920 0.80 JAK2 (0.52) JAK2JAK3PTK2JAK1
SCHEMBL13536189 0.80 JAK2 (0.52) JAK2JAK3PTK2JAK1
SCHEMBL16394396 0.74 JAK2 (0.49) JAK2JAK3PTK2
SCHEMBL13535777 0.74 JAK2 (0.77) JAK2JAK3PTK2

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