SCHEMBL14063471

SCHEMBL14063471

COc1ccc(F)cc1C(=O)CNc1nc(-c2ccncc2)cc(=O)n1C

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 16/20 0.71
▸ CYP2D6 P10635 2/20 0.45

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
SCHEMBL13910320 0.93 GSK3B (0.71) GSK3BCYP2D6
SCHEMBL13910421 0.90 GSK3B (0.64) GSK3B
SCHEMBL14063468 0.89 GSK3B (0.75) GSK3B
SCHEMBL13910263 0.89 GSK3B (0.63) GSK3BCYP2D6
SCHEMBL13721482 0.88 GSK3B (0.55) GSK3BCYP2D6
SCHEMBL13910424 0.86 GSK3B (0.80) GSK3BCYP2D6
SCHEMBL13910317 0.85 GSK3B (0.73) GSK3BCYP2D6
SCHEMBL13910423 0.84 GSK3B (0.69) GSK3B
SCHEMBL13910495 0.83 GSK3B (0.71) GSK3B
SCHEMBL4028335 0.83 GSK3B (1.00) GSK3BCYP2D6

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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