SCHEMBL3668859

SCHEMBL3668859

CC(O)Cc1cc(F)c(-c2cc(C(N)=O)cs2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.32
TMPRSS15 P98073 1/20 0.32
DPP4 P27487 2/20 0.31

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
SCHEMBL1428013 0.78 IKBKB (0.43)
SCHEMBL3668858 0.74 JAK2 (0.38)
SCHEMBL13621105 0.72 DAO (0.47) PRSS1TMPRSS15
SCHEMBL1579873 0.68 JAK2 (0.42)
SCHEMBL21956735 0.66 FABP3 (0.36)
SCHEMBL3671648 0.65 IKBKB (0.43)
SCHEMBL30125238 0.63 IKBKB (0.51)
SCHEMBL1249626 0.62 PIK3CD (0.32)
SCHEMBL21957026 0.62 BDKRB1 (0.38) DPP4
SCHEMBL24956333 0.62 RAB9A (0.48)

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 4 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
EP-2166846-A1 INHIBITORS OF JANUS KINASES Merck Sharp & Dohme Corp. (US) 2010-03-31 EP disclosed
WO-2008156726-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2008-12-24 WO disclosed