SCHEMBL13722383

SCHEMBL13722383

Cn1c(NCC(=O)c2ccc(-c3cccnc3)cc2)nc(-c2ccncn2)cc1=O

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 13/20 0.60
▸ BACE1 P56817 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39

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
SCHEMBL13722101 0.93 GSK3B (0.70) GSK3B
SCHEMBL13722107 0.92 GSK3B (0.60) GSK3BBACE1
SCHEMBL13721909 0.91 GSK3B (0.70) GSK3B
SCHEMBL13721945 0.90 GSK3B (0.62) GSK3B
SCHEMBL14063491 0.89 GSK3B (0.76) GSK3BBACE1MKNK1MKNK2
SCHEMBL13721929 0.87 GSK3B (0.58) GSK3B
SCHEMBL4031690 0.86 GSK3B (0.75) GSK3B
SCHEMBL13722148 0.86 GSK3B (0.68) GSK3B
SCHEMBL13721903 0.86 GSK3B (0.69) GSK3B
SCHEMBL13722185 0.86 GSK3B (0.62) GSK3B

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
US-7572793-B2 3-Substituted-4-pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-11 — — US disclosed
US-7572793-B2 3-Substituted-4-pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-11 — — US disclosed
Send feedback