SCHEMBL13910455

SCHEMBL13910455

Cn1c(NCC(=O)c2ccc(Cl)c(Cl)c2)nc(-c2ccncc2)cc1=O

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 12/20 0.76
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ AGTR1 P30556 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
SCHEMBL13910833 0.89 GSK3B (0.80) GSK3B
SCHEMBL13910485 0.88 GSK3B (0.85) GSK3B
SCHEMBL13910329 0.88 GSK3B (0.89) GSK3B
SCHEMBL13721505 0.87 GSK3B (0.59) GSK3B
SCHEMBL4025237 0.87 GSK3B (1.00) GSK3B
SCHEMBL13910835 0.86 GSK3B (0.82) GSK3B
SCHEMBL13910315 0.86 GSK3B (0.82) GSK3B
SCHEMBL13910508 0.85 GSK3B (0.80) GSK3B
SCHEMBL14063466 0.85 GSK3B (0.80) GSK3B
SCHEMBL4028335 0.85 GSK3B (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1427720-B1 3-SUBSTITUTED-4-PYRIMIDONE DERIVATIVES MITSUBISHI TANABE PHARMA CORP (JP) 2009-03-04 — — EP disclosed
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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