SCHEMBL14063478

SCHEMBL14063478

Cn1c(NCC(=O)c2ccc(CN3CCOCC3)cc2)nc(-c2ccncc2)cc1=O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 11/20 0.67
▸ TBK1 Q9UHD2 1/20 0.45
▸ DYRK1A Q13627 2/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ EPAS1 Q99814 1/20 0.41

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
SCHEMBL13910130 0.92 GSK3B (0.71) GSK3B
SCHEMBL14063476 0.91 GSK3B (0.69) GSK3B
SCHEMBL13721556 0.89 GSK3B (0.52) GSK3B
SCHEMBL13910485 0.84 GSK3B (0.85) GSK3B
SCHEMBL13910329 0.83 GSK3B (0.89) GSK3B
SCHEMBL13910833 0.83 GSK3B (0.80) GSK3B
SCHEMBL13910470 0.82 GSK3B (0.73) GSK3B
SCHEMBL13910846 0.82 GSK3B (0.70) GSK3BHIF1A
SCHEMBL13910315 0.82 GSK3B (0.82) GSK3B
SCHEMBL13910835 0.82 GSK3B (0.82) 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-7427615-B2 3-substituted-4-pyrimidone derivatives MITSUBISHI PHARMA CORPORATION (JP) 2008-09-23 — — US disclosed
US-7427615-B2 3-substituted-4-pyrimidone derivatives MITSUBISHI PHARMA CORPORATION (JP) 2008-09-23 — — US disclosed
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