SCHEMBL16854059

SCHEMBL16854059

Cc1c(C(=O)N=S(C)(C)=O)cn2ncnc(Nc3ccc(F)cc3O[C@H]3CCOC3)c12

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MKNK2 Q9HBH9 20/20 0.55
▸ MKNK1 Q9BUB5 9/20 0.55
▸ EIF4E P06730 1/20 0.49

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
SCHEMBL16854170 0.94 MKNK2 (0.51) MKNK2MKNK1EIF4E
SCHEMBL16854164 0.92 MKNK2 (0.49) MKNK2MKNK1EIF4E
SCHEMBL16853998 0.92 MKNK2 (0.51) MKNK2MKNK1EIF4E
SCHEMBL16854016 0.89 MKNK2 (0.53) MKNK2MKNK1EIF4E
SCHEMBL16853997 0.89 MKNK2 (0.55) MKNK2MKNK1EIF4E
SCHEMBL16854169 0.87 MKNK2 (0.51) MKNK2MKNK1EIF4E
SCHEMBL16854065 0.85 MKNK2 (0.49) MKNK2MKNK1EIF4E
SCHEMBL16854040 0.85 MKNK2 (0.44) MKNK2MKNK1EIF4E
SCHEMBL16854030 0.85 MKNK2 (0.56) MKNK2MKNK1
SCHEMBL16854175 0.84 MKNK2 (0.57) MKNK2MKNK1

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-2015091156-A1 SULFOXIMINE SUBSTITUTED PYRROLOTRIAZINES FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-06-25 — — WO disclosed
Send feedback