SCHEMBL24201720

SCHEMBL24201720

C/C(=N\c1c(C)ncnc1N1CCc2cc(C)ccc21)C(=O)NCCN1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
NPSR1 Q6W5P4 2/20 0.39
NPC1 O15118 1/20 0.39
EIF4E P06730 2/20 0.36
MKNK1 Q9BUB5 2/20 0.36
MKNK2 Q9HBH9 2/20 0.36
NOTUM Q6P988 1/20 0.35
EGFR P00533 3/20 0.34
ATR Q13535 1/20 0.34
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
SIRT3 Q9NTG7 1/20 0.34
KCNQ2 O43526 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SRD5A1 P18405 1/20 0.33

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
SCHEMBL24202016 0.93 MKNK1 (0.36) KMT2AMEN1NPSR1EIF4EMKNK1
SCHEMBL23761212 0.92 MKNK1 (0.45) NPSR1NPC1EIF4EMKNK1MKNK2
SCHEMBL24201711 0.88 MKNK1 (0.44) KMT2AMEN1EIF4EMKNK1MKNK2
SCHEMBL23761391 0.85 MKNK1 (0.45) KMT2AMEN1EIF4EMKNK1MKNK2
SCHEMBL24202077 0.83 MKNK1 (0.37) KMT2AMEN1EIF4EMKNK1MKNK2
SCHEMBL24202175 0.83 MKNK1 (0.45) NPSR1EIF4EMKNK1MKNK2NOTUM
SCHEMBL23761356 0.83 MKNK1 (0.33) NPSR1EIF4EMKNK1MKNK2NOTUM
SCHEMBL23761657 0.81 MKNK1 (0.49) EIF4EMKNK1MKNK2NOTUMSIRT2
SCHEMBL23761530 0.79 NOTUM (0.40) NPSR1NPC1EIF4EMKNK1MKNK2
SCHEMBL24202017 0.79 NOTUM (0.41) NPSR1NPC1EIF4EMKNK1MKNK2

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-3939981-A1 FUSED THIAZOLOPYRIMIDINE DERIVATIVES AS MNKS INHIBITORS LifeArc (GB) 2022-01-19 EP disclosed