SCHEMBL497227

SCHEMBL497227

Cn1c(Cl)nc(-c2ccncc2)cc1=O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 19/20 0.52
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
KDM5B Q9UGL1 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
Hydrochloric Acid SCHEMBL3819113 0.98 GSK3B (0.51) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL83555 0.83 GSK3B (0.49) GSK3BCDC7ROCK2MAP4K4HIPK2
SCHEMBL12207381 0.80 GSK3B (0.52) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL1673943 0.80 GSK3B (0.52) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL3804927 0.80 GSK3B (0.56) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL101767 0.80 GSK3B (0.60) GSK3B
SCHEMBL3743033 0.78 GSK3B (0.50) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL2488368 0.76 GSK3B (0.49) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL7385338 0.76 GSK3B (0.59) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL81844 0.76 GSK3B (0.50) 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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111349085-B Pyrimidone compounds or pharmaceutically acceptable salts thereof, preparation method and application 中国药科大学 2021-02-09 CN disclosed
CN-111349085-A Pyrimidone compounds or pharmaceutically acceptable salts thereof, preparation method and application 中国药科大学 2020-06-30 CN disclosed
US-9006232-B2 Pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-04-14 US disclosed
US-9006232-B2 Pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-04-14 US disclosed
US-9006232-B2 Pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-04-14 US disclosed
EP-1572681-B1 3-SUBSTITUTED-4-PYRIMIDONE DERIVATIVES MITSUBISHI TANABE PHARMA CORP (JP) 2014-01-22 EP disclosed
US-8569294-B2 2-(cyclic amino)-pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-10-29 US disclosed
US-20120208797-A1 PYRIMIDONE DERIVATIVES SANOFI (FR) 2012-08-16 US disclosed
US-20120208797-A1 PYRIMIDONE DERIVATIVES SANOFI (FR) 2012-08-16 US disclosed
US-20120208797-A1 PYRIMIDONE DERIVATIVES SANOFI (FR) 2012-08-16 US disclosed
WO-2006028290-A1 2-MORPHOLINO-4-PYRIMIDONE COMPOUND MITSUBISHI PHARMA CORPORATION (JP) 2006-03-16 WO disclosed
CN-1726209-A 3-substituted-4-pyrimidone derivatives SANOFI AVENTIS (JP) 2006-01-25 CN disclosed
EP-1608630-A1 2, 3, 6-TRISUBSTITUTED-4-PYRIMIDONE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2005-12-28 EP disclosed
EP-1572681-A1 3-SUBSTITUTED-4-PYRIMIDONE DERIVATIVES MITSUBISHI PHARMA CORPORATION (JP) 2005-09-14 EP disclosed
US-20050090490-A1 3-Substituted-4-pyrimidone derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2005-04-28 US disclosed
CN-1556804-A 3-substituted-4-pyrimidone derivatives ������ҩ��ʽ���� 2004-12-22 CN disclosed
WO-2004085408-A1 2, 3, 6-TRISUBSTITUTED-4-PYRIMIDONE DERIVATIVES MITSUBISHI PHARMA CORPORATION (JP) 2004-10-07 WO disclosed
WO-2004055007-A1 3-SUBSTITUTED-4-PYRIMIDONE DERIVATIVES MITSUBISHI PHARMA CORPORATION (JP) 2004-07-01 WO disclosed
EP-1427720-A1 3-SUBSTITUTED-4-PYRIMIDONE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2004-06-16 EP disclosed
WO-2003037888-A1 3-SUBSTITUTED-4-PYRIMIDONE DERIVATIVES MITSUBISHI PHARMA CORPORATION (JP) 2003-05-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120208797-A1 PYRIMIDONE DERIVATIVES PSEN1, PRNP, PSEN2 GSK3B 256/4885CDC7 1782/4885ROCK2 884/4885
US-20050090490-A1 3-Substituted-4-pyrimidone derivatives CDK1, TTBK1, CDK2 GSK3B 247/4885CDC7 1127/4885ROCK2 831/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.