SCHEMBL4762806

SCHEMBL4762806

N#CCCOC12CC3CC(C1)C(Nc1cc[nH]c1)C(C3)C2

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ JAK3 P52333 1/20 0.32

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
SCHEMBL12875978 0.73 HRH2 (0.36) —
SCHEMBL12888835 0.72 JAK3 (0.51) JAK2JAK1JAK3
SCHEMBL4761600 0.72 JAK2 (0.44) JAK2JAK1JAK3
SCHEMBL4762436 0.72 JAK2 (0.44) JAK2JAK1JAK3
SCHEMBL4762760 0.72 JAK2 (0.31) JAK2JAK1JAK3
SCHEMBL12887985 0.70 JAK1 (0.62) JAK2JAK1JAK3
SCHEMBL12861459 0.70 — —
SCHEMBL12876670 0.69 JAK1 (0.73) JAK2JAK1JAK3
SCHEMBL12888836 0.69 JAK1 (0.73) JAK2JAK1JAK3
SCHEMBL1155116 0.69 JAK1 (0.73) JAK2JAK1JAK3

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-1966200-A1 HETEROCYCLIC JANUS KINASE 3 INHIBITORS Astellas Pharma Inc. (JP) 2008-09-10 — — EP disclosed
WO-2007077949-A1 HETEROCYCLIC JANUS KINASE 3 INHIBITORS ASTELLAS PHARMA INC. (JP) 2007-07-12 — — WO disclosed
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