SCHEMBL20146857

SCHEMBL20146857

CC(=O)Nc1cc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)ccc1C(O)N1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 17/20 0.56
MKNK2 Q9HBH9 17/20 0.56
EIF4E P06730 1/20 0.56
CYP3A4 P08684 1/20 0.48
FYN P06241 1/20 0.42
EGLN2 Q96KS0 1/20 0.38
RAD52 P43351 1/20 0.37

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
SCHEMBL16291305 0.84 MKNK1 (0.68) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL19243715 0.80 MKNK1 (0.66) MKNK1MKNK2EIF4ECYP3A4
SCHEMBL15288199 0.78 MKNK1 (0.52) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL15288470 0.77 MKNK1 (0.50) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL15288559 0.77 MKNK1 (0.70) MKNK1MKNK2EIF4ECYP3A4
SCHEMBL15286279 0.76 MKNK1 (0.69) MKNK1MKNK2EIF4ECYP3A4RAD52
SCHEMBL15288359 0.76 MKNK1 (0.56) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL16304115 0.74 MKNK1 (0.76) MKNK1MKNK2EIF4ECYP3A4
SCHEMBL15288054 0.74 MKNK1 (0.53) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL15288395 0.73 MKNK1 (0.75) MKNK1MKNK2EIF4ECYP3A4

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