SCHEMBL15032696

SCHEMBL15032696

CCOC(=O)c1c[nH]c2ncnc(-c3ccc(NC)cc3)c12

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 20/20 0.79
JAK2 O60674 19/20 0.79

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
SCHEMBL16245302 0.90 JAK2 (0.84) JAK3JAK2
SCHEMBL16245118 0.88 JAK2 (1.00) JAK3JAK2
SCHEMBL15032794 0.88 JAK2 (1.00) JAK3JAK2
SCHEMBL16245306 0.87 JAK2 (0.81) JAK3JAK2
SCHEMBL15032690 0.87 JAK2 (1.00) JAK3JAK2
SCHEMBL16245120 0.87 JAK3 (0.81) JAK3JAK2
SCHEMBL15032680 0.87 JAK3 (1.00) JAK3JAK2
SCHEMBL16245014 0.87 JAK3 (0.79) JAK3JAK2
SCHEMBL15032687 0.86 JAK2 (0.79) JAK3JAK2
SCHEMBL15032706 0.86 JAK2 (0.80) JAK3JAK2

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-2013085802-A1 PYRROLOPYRIMIDINES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2013-06-13 WO disclosed