SCHEMBL20146809

SCHEMBL20146809

N#Cc1ccc(-c2cnc3cnc(-c4ccc(C=O)c(Cl)c4)cn23)cc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 7/20 0.52
MKNK2 Q9HBH9 7/20 0.52
FYN P06241 11/20 0.46
CYP3A4 P08684 1/20 0.41
GRK5 P34947 1/20 0.41
CHEK1 O14757 1/20 0.40
GSK3B P49841 1/20 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
SCHEMBL20146788 0.87 MKNK1 (0.52) MKNK1MKNK2FYNCYP3A4GRK5
SCHEMBL15288743 0.82 MKNK1 (0.56) MKNK1MKNK2FYNCYP3A4CHEK1
SCHEMBL19243695 0.82 MKNK1 (0.60) MKNK1MKNK2FYNCYP3A4CHEK1
SCHEMBL20146888 0.81 MKNK1 (0.52) MKNK1MKNK2FYNCYP3A4
SCHEMBL16331348 0.81 FYN (0.70) MKNK1MKNK2FYNCHEK1GSK3B
SCHEMBL16331186 0.77 MKNK1 (0.69) MKNK1MKNK2FYNCHEK1GSK3B
SCHEMBL16304085 0.76 MKNK1 (0.52) MKNK1MKNK2FYNCYP3A4CHEK1
SCHEMBL16304099 0.76 MKNK1 (0.49) MKNK1MKNK2FYNCYP3A4CHEK1
SCHEMBL15288456 0.75 MKNK1 (0.50) MKNK1MKNK2FYNCYP3A4CHEK1
SCHEMBL15288103 0.74 MKNK1 (0.70) 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