SCHEMBL20146864

SCHEMBL20146864

CN1CCN(C(O)c2ccc(-c3ccc4ncc(-c5ccc(C#N)cc5)n4c3)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 14/20 0.66
MKNK2 Q9HBH9 14/20 0.66
CYP3A4 P08684 1/20 0.66
EIF4E P06730 1/20 0.53
FYN P06241 6/20 0.40

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
SCHEMBL19243847 0.89 MKNK1 (0.55) MKNK1MKNK2CYP3A4EIF4EFYN
SCHEMBL19243715 0.88 MKNK1 (0.66) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL20146929 0.85 MKNK1 (0.52) MKNK1MKNK2CYP3A4EIF4EFYN
SCHEMBL19243768 0.85 MKNK1 (0.51) MKNK1MKNK2CYP3A4EIF4EFYN
SCHEMBL20146796 0.82 MKNK1 (0.58) MKNK1MKNK2CYP3A4FYN
SCHEMBL20418033 0.81 MKNK1 (0.71) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL15286459 0.80 MKNK1 (1.00) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL20146782 0.78 MKNK1 (0.54) MKNK1MKNK2CYP3A4EIF4EFYN
SCHEMBL15298890 0.77 MKNK1 (0.74) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL15288441 0.77 MKNK1 (0.93) MKNK1MKNK2CYP3A4EIF4E

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
EP-3321268-A1 BICYCLIC HETEROARYL DERIVATIVES AS MNK1 AND MNK2 MODULATORS AND USES THEREOF Agency For Science, Technology And Research (SG) 2018-05-16 EP disclosed