SCHEMBL3713183

SCHEMBL3713183

NC(=O)c1cnc(Nc2ccc(Cl)c(NC(=O)C3CC3)c2)nc1NCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 4/20 0.54
JAK2 O60674 1/20 0.54
JAK1 P23458 1/20 0.54
STAT6 P42226 16/20 0.52

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
SCHEMBL3712344 0.88 JAK3 (0.59) JAK3JAK2JAK1STAT6
SCHEMBL3715842 0.87 JAK3 (0.51) JAK3JAK2JAK1STAT6
SCHEMBL3711925 0.87 JAK3 (0.58) JAK3JAK2JAK1STAT6
SCHEMBL3714501 0.87 JAK3 (0.58) JAK3JAK2JAK1STAT6
SCHEMBL3718768 0.85 JAK3 (0.55) JAK3JAK2JAK1STAT6
SCHEMBL3723332 0.85 STAT6 (0.55) JAK3JAK2JAK1STAT6
SCHEMBL3715522 0.85 JAK3 (0.55) JAK3JAK2JAK1STAT6
SCHEMBL3715960 0.83 STAT6 (0.57) JAK3JAK2JAK1STAT6
SCHEMBL3721948 0.82 ACVRL1 (0.52) JAK3JAK2JAK1
SCHEMBL914371 0.82 SYK (0.55)

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-2010129802-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2010-11-11 WO disclosed