SCHEMBL4762760

SCHEMBL4762760

BrC12CC3CC(C1)C(Nc1cc[nH]c1)C(C3)C2

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 4/20 0.31
▸ JAK1 P23458 4/20 0.31
▸ TYK2 P29597 3/20 0.31
▸ JAK3 P52333 3/20 0.31

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
SCHEMBL4762436 0.82 JAK2 (0.44) JAK2JAK1TYK2JAK3
SCHEMBL4761600 0.82 JAK2 (0.44) JAK2JAK1TYK2JAK3
SCHEMBL4762806 0.72 JAK2 (0.32) JAK2JAK1JAK3
SCHEMBL4761963 0.66 EPHX2 (0.39) JAK2JAK1JAK3
SCHEMBL9216465 0.64 LMNA (0.32) —
SCHEMBL21356705 0.63 HRH3 (0.36) —
SCHEMBL6534113 0.62 — —
SCHEMBL29883492 0.59 MEN1 (0.30) —
SCHEMBL2732462 0.59 HSD11B1 (0.44) JAK2JAK1TYK2JAK3
SCHEMBL1074040 0.59 — —

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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