SCHEMBL16719942

SCHEMBL16719942

CN(C)c1nc[c]cc1-c1ccncc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ LATS1 O95835 1/20 0.37
▸ LATS2 Q9NRM7 1/20 0.37
▸ CHRM5 P08912 1/20 0.36
▸ CHKA P35790 1/20 0.36
▸ MAPK11 Q15759 3/20 0.36
▸ MAPK14 Q16539 3/20 0.36
▸ CSNK1D P48730 2/20 0.36
▸ LMNA P02545 1/20 0.33
▸ ROCK2 O75116 2/20 0.33
▸ ROCK1 Q13464 2/20 0.33
▸ CSNK1E P49674 1/20 0.32
▸ NTRK1 P04629 1/20 0.32
▸ ADK P55263 1/20 0.32
▸ CDC7 O00311 1/20 0.31
▸ DBF4 Q9UBU7 1/20 0.31
▸ NFATC1 O95644 1/20 0.30
▸ GSK3B P49841 1/20 0.30
▸ DYRK1A Q13627 1/20 0.30

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
SCHEMBL16719607 0.84 LRRK2 (0.42) SMN1; SMN2MAPK11MAPK14CSNK1DLMNA
SCHEMBL2377871 0.73 FYN (0.40) MAPTSMN1; SMN2LMNANTRK1MEN1
SCHEMBL5914464 0.73 KDM4E (0.46) MAPTSMN1; SMN2LATS1LATS2CHRM5
SCHEMBL16720031 0.69 BRAF (0.40) MEN1KMT2A
Water SCHEMBL27555359 0.67 MAPT (0.41) MAPTSMN1; SMN2LATS1LATS2CHRM5
Water SCHEMBL7844031 0.67 MAPT (0.41) MAPTSMN1; SMN2LATS1LATS2CHRM5
SCHEMBL1450726 0.66 — —
SCHEMBL5256819 0.64 MAPT (0.42) MAPTSMN1; SMN2LATS1LATS2CHRM5
SCHEMBL9958013 0.63 MAPT (0.43) MAPTSMN1; SMN2MAPK14LMNANFATC1
SCHEMBL31193319 0.63 ADORA2B (0.42) MAPTSMN1; SMN2LATS1LATS2CHRM5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3068758-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE The Wistar Institute Of Anatomy And Biology (US) 2016-09-21 — — EP disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 — — WO disclosed
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