SCHEMBL14628873

SCHEMBL14628873

Nc1ccc(-c2ccc(C(=O)N3CCC[C@@H](n4c(=O)[nH]c5cnc6[nH]ccc6c54)C3)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.65
JAK3 P52333 20/20 0.65
JAK1 P23458 18/20 0.65

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
SCHEMBL2055030 0.92 JAK2 (0.66) JAK2JAK3JAK1
SCHEMBL2055020 0.92 JAK2 (0.65) JAK2JAK3JAK1
SCHEMBL2054996 0.90 JAK2 (0.62) JAK2JAK3JAK1
SCHEMBL2055005 0.90 JAK2 (0.62) JAK2JAK3JAK1
SCHEMBL2055019 0.90 JAK2 (0.69) JAK2JAK3JAK1
SCHEMBL2055001 0.87 JAK2 (0.60) JAK2JAK3JAK1
SCHEMBL2055014 0.87 JAK2 (0.60) JAK2JAK3JAK1
SCHEMBL2055024 0.87 JAK2 (0.60) JAK2JAK3JAK1
SCHEMBL2055004 0.87 JAK2 (0.68) JAK2JAK3JAK1
SCHEMBL2055027 0.87 JAK2 (0.65) JAK2JAK3JAK1

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-2007007919-A2 HETEROCYCLIC JANUS KINASE 3 INHIBITORS ASTELLAS PHARMA INC. (JP) 2007-01-18 WO disclosed