SCHEMBL20146865

SCHEMBL20146865

N#Cc1ccc(-c2cnc3ccc(-c4ccc(C(O)N5CCNCC5)cc4F)cn23)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 8/20 0.44
MKNK2 Q9HBH9 8/20 0.44
CYP3A4 P08684 2/20 0.44
EIF4E P06730 1/20 0.44
EGLN2 Q96KS0 1/20 0.36
OPRD1 P41143 1/20 0.36
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
IRAK1 P51617 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
NTRK1 P04629 6/20 0.35
NTRK3 Q16288 6/20 0.35
NTRK2 Q16620 6/20 0.35
TGFBR1 P36897 2/20 0.35

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 0.81 MKNK1 (0.55) MKNK1MKNK2CYP3A4EIF4EEGLN2
SCHEMBL20146866 0.80 MKNK1 (0.61) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL19243768 0.79 MKNK1 (0.51) MKNK1MKNK2CYP3A4EIF4EEGLN2
SCHEMBL19243715 0.76 MKNK1 (0.66) MKNK1MKNK2CYP3A4EIF4ENTRK1
SCHEMBL20146864 0.76 MKNK1 (0.66) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL20146796 0.73 MKNK1 (0.58) MKNK1MKNK2CYP3A4
SCHEMBL20146929 0.73 MKNK1 (0.52) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL31608575 0.73 MKNK1 (0.77) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL15288854 0.73 MKNK1 (0.77) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL16304120 0.72 MKNK1 (0.51) MKNK1MKNK2CYP3A4EIF4EPRMT5

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