SCHEMBL13910475

SCHEMBL13910475

Cn1c(NCC(=O)c2ccccc2-c2ccccc2)nc(-c2ccncc2)cc1=O

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 18/20 0.78
▸ CDC7 O00311 1/20 0.47
▸ ROCK2 O75116 1/20 0.47
▸ MAP4K4 O95819 1/20 0.47
▸ PIM1 P11309 1/20 0.47
▸ PRKACA P17612 1/20 0.47
▸ HIPK2 Q9H2X6 1/20 0.47
▸ CLK4 Q9HAZ1 1/20 0.47

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
SCHEMBL13910844 0.98 GSK3B (0.81) GSK3B
SCHEMBL14063490 0.93 GSK3B (0.74) GSK3B
SCHEMBL13910517 0.90 GSK3B (0.72) GSK3B
SCHEMBL13910357 0.89 GSK3B (0.71) GSK3B
SCHEMBL13910399 0.88 GSK3B (0.79) GSK3B
SCHEMBL13910847 0.88 GSK3B (0.70) GSK3B
SCHEMBL13910499 0.88 GSK3B (0.70) GSK3B
SCHEMBL13722387 0.88 GSK3B (0.67) GSK3B
SCHEMBL13721913 0.88 GSK3B (0.61) GSK3B
SCHEMBL13910490 0.88 GSK3B (0.69) 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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