SCHEMBL8344208

SCHEMBL8344208

Cn1c(N2CCNC(c3ccc(N4CCN(C(=O)OCc5ccccc5)CC4)cc3)C2)nc(-c2ccncc2)cc1=O

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 20/20 0.67
▸ CYP2D6 P10635 4/20 0.61

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
SCHEMBL13917136 0.91 GSK3B (0.63) GSK3B
SCHEMBL87897 0.89 GSK3B (0.52) GSK3BCYP2D6
SCHEMBL8344279 0.87 GSK3B (0.85) GSK3BCYP2D6
SCHEMBL8344799 0.86 GSK3B (0.47) GSK3BCYP2D6
SCHEMBL8344260 0.83 GSK3B (0.78) GSK3BCYP2D6
SCHEMBL1651319 0.83 GSK3B (0.78) GSK3BCYP2D6
SCHEMBL13914961 0.83 GSK3B (0.75) GSK3BCYP2D6
SCHEMBL13914950 0.82 GSK3B (0.65) GSK3BCYP2D6
SCHEMBL8341183 0.82 GSK3B (0.79) GSK3BCYP2D6
SCHEMBL8342812 0.82 GSK3B (0.79) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504411-B2 2,3,6-Trisubstituted-4-pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-03-17 — — US disclosed
US-7504411-B2 2,3,6-Trisubstituted-4-pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-03-17 — — US disclosed
WO-2004085408-A1 2, 3, 6-TRISUBSTITUTED-4-PYRIMIDONE DERIVATIVES MITSUBISHI PHARMA CORPORATION (JP) 2004-10-07 — — WO disclosed
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