SCHEMBL14548740

SCHEMBL14548740

O=c1[nH]ccc2c(Nc3c(Cl)cc(F)cc3CI)nc3ccc(NCC(O)C(F)(F)F)cc3c12

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.51
KCNH2 Q12809 1/20 0.36

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
SCHEMBL2861481 0.94 JAK2 (0.58) JAK2KCNH2
SCHEMBL3501915 0.83 JAK2 (0.58) JAK2
SCHEMBL13248917 0.81 JAK2 (0.52) JAK2
SCHEMBL14548738 0.80 JAK2 (0.48) JAK2
SCHEMBL3501108 0.80 JAK2 (0.55) JAK2
SCHEMBL14548750 0.80 JAK2 (0.46) JAK2
SCHEMBL2867451 0.79 JAK2 (0.61) JAK2KCNH2
SCHEMBL2858014 0.78 JAK2 (0.53) JAK2
SCHEMBL2867519 0.78 JAK2 (0.58) JAK2KCNH2
SCHEMBL11981754 0.76 JAK2 (0.51) JAK2KCNH2

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
US-8349865-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-01-08 US disclosed