SCHEMBL5380512

SCHEMBL5380512

CCCc1nc(=O)cc(-c2ccncc2)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.51
KDM4C Q9H3R0 1/20 0.47
CDC7 O00311 8/20 0.43
PDE10A Q9Y233 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
GPR84 Q9NQS5 5/20 0.40

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
SCHEMBL5386248 0.91 GSK3B (0.63) GSK3BKDM4CCDC7PDE10AGPR84
SCHEMBL5381257 0.90 GSK3B (0.58) GSK3BCDC7GPR84
SCHEMBL5400093 0.89 GSK3B (0.56) GSK3BCDC7GPR84
SCHEMBL5381271 0.89 GSK3B (0.56) GSK3BCDC7GPR84
SCHEMBL5376002 0.89 GSK3B (0.56) GSK3BCDC7GPR84
SCHEMBL5399975 0.88 CDC7 (0.48) GSK3BCDC7PDE3BPDE3A
SCHEMBL5390451 0.86 GSK3B (0.45) GSK3BCDC7PDE3BPDE3AGPR84
SCHEMBL5382469 0.82 GSK3B (0.49) GSK3BCDC7GPR84
SCHEMBL5390682 0.81 GSK3B (0.64) GSK3BCDC7PDE10A
SCHEMBL5386570 0.81 GSK3B (0.62) GSK3BCDC7PDE10A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7256199-B1 Pyrimidone derivatives MITSUBISHI CHEMICAL CORPORATION (JP) 2007-08-14 US disclosed
EP-1115721-B1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEM CORP (JP) 2003-12-10 EP disclosed
EP-1115721-A1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-18 EP disclosed
WO-2000018758-A1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 2000-04-06 WO disclosed