SCHEMBL13910359

SCHEMBL13910359

Cn1c(NCC(=O)c2cc3ccccc3o2)nc(-c2ccncc2)cc1=O

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 17/20 0.70
▸ NPC1 O15118 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL13721935 0.88 GSK3B (0.53) GSK3BNPC1ALDH1A1MAPT
SCHEMBL13910333 0.83 GSK3B (0.70) GSK3B
SCHEMBL4028435 0.82 GSK3B (1.00) GSK3B
SCHEMBL13910329 0.81 GSK3B (0.89) GSK3B
SCHEMBL13910508 0.81 GSK3B (0.80) GSK3B
SCHEMBL13910844 0.81 GSK3B (0.81) GSK3B
SCHEMBL13910852 0.81 GSK3B (0.77) GSK3B
SCHEMBL13910358 0.80 GSK3B (0.76) GSK3B
SCHEMBL13910399 0.80 GSK3B (0.79) GSK3B
SCHEMBL13910321 0.80 GSK3B (0.90) 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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