SCHEMBL20146796

SCHEMBL20146796

CN1CCN(C(O)c2ccc(-c3cn4c(-c5ccc(C#N)cc5)cnc4cn3)c(O)c2)CC1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 10/20 0.58
MKNK2 Q9HBH9 10/20 0.58
FYN P06241 10/20 0.48
CYP3A4 P08684 1/20 0.48

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 0.90 MKNK1 (0.55) MKNK1MKNK2FYNCYP3A4
SCHEMBL20146864 0.82 MKNK1 (0.66) MKNK1MKNK2FYNCYP3A4
SCHEMBL19243768 0.81 MKNK1 (0.51) MKNK1MKNK2FYNCYP3A4
SCHEMBL15288190 0.80 MKNK1 (0.83) MKNK1MKNK2CYP3A4
SCHEMBL19243866 0.79 MKNK1 (0.70) MKNK1MKNK2FYNCYP3A4
SCHEMBL20146786 0.77 MKNK1 (0.54) MKNK1MKNK2FYNCYP3A4
SCHEMBL15288581 0.75 MKNK1 (0.79) MKNK1MKNK2CYP3A4
SCHEMBL15288575 0.74 MKNK1 (1.00) MKNK1MKNK2CYP3A4
SCHEMBL20146865 0.73 MKNK1 (0.44) MKNK1MKNK2CYP3A4
SCHEMBL15286159 0.73 MKNK1 (0.80) MKNK1MKNK2FYNCYP3A4

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