SCHEMBL20146929

SCHEMBL20146929

N#Cc1ccc(-c2cnc3ccc(-c4ccc(C(O)N5CCN(c6ccncc6)CC5)cc4)cn23)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 12/20 0.52
MKNK2 Q9HBH9 12/20 0.52
EIF4E P06730 1/20 0.52
CYP3A4 P08684 1/20 0.49
HRH1 P35367 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
FYN P06241 4/20 0.41
PIK3CA P42336 2/20 0.37
MTOR P42345 2/20 0.37
CHEK1 O14757 1/20 0.36

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
SCHEMBL19243715 0.85 MKNK1 (0.66) MKNK1MKNK2EIF4ECYP3A4
SCHEMBL20146864 0.85 MKNK1 (0.66) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL15288936 0.81 MKNK1 (0.75) MKNK1MKNK2EIF4ECYP3A4
SCHEMBL18609486 0.79 MKNK1 (0.57) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL20418033 0.78 MKNK1 (0.71) MKNK1MKNK2EIF4ECYP3A4
SCHEMBL19243847 0.75 MKNK1 (0.55) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL15288596 0.73 MKNK1 (0.76) MKNK1MKNK2EIF4ECYP3A4
SCHEMBL20146865 0.73 MKNK1 (0.44) MKNK1MKNK2EIF4ECYP3A4
SCHEMBL19243768 0.72 MKNK1 (0.51) MKNK1MKNK2EIF4ECYP3A4FYN
SCHEMBL16304120 0.72 MKNK1 (0.51) MKNK1MKNK2EIF4ECYP3A4FYN

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