SCHEMBL3677484

SCHEMBL3677484

Cc1cccc(Nc2sc(-c3c[nH]nc3C)cc2C(N)=O)n1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.68
JAK3 P52333 2/20 0.47
KCNH2 Q12809 2/20 0.43

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
SCHEMBL3508992 0.81 JAK2 (1.00) JAK2JAK3
SCHEMBL3510299 0.81 JAK2 (1.00) JAK2JAK3KCNH2
SCHEMBL3511304 0.81 JAK2 (1.00) JAK2JAK3KCNH2
SCHEMBL3509413 0.80 JAK2 (1.00) JAK2JAK3KCNH2
SCHEMBL3513284 0.79 JAK2 (1.00) JAK2JAK3KCNH2
SCHEMBL3512253 0.79 JAK2 (0.85) JAK2JAK3KCNH2
SCHEMBL3508881 0.79 JAK2 (0.81) JAK2JAK3KCNH2
SCHEMBL3509539 0.78 JAK2 (0.79) JAK2JAK3KCNH2
SCHEMBL3508076 0.78 JAK2 (1.00) JAK2JAK3
SCHEMBL3512007 0.78 JAK2 (0.75) JAK2JAK3KCNH2

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-2166846-A1 INHIBITORS OF JANUS KINASES Merck Sharp & Dohme Corp. (US) 2010-03-31 EP claimed
WO-2008156726-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2008-12-24 WO claimed