SCHEMBL7743913

SCHEMBL7743913

Cc1ccc(Cc2cnc(N[N+](=O)[O-])[nH]c2=O)c[n+]1[O-]

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 14/20 0.36
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL11001555 0.82 PLA2G7 (0.37) PLA2G7
SCHEMBL10620753 0.81 PLA2G7 (0.51) PLA2G7
SCHEMBL10651417 0.80 PLA2G7 (0.36) PLA2G7
SCHEMBL10653869 0.78 PLA2G7 (0.46) PLA2G7
SCHEMBL10848628 0.78 PLA2G7 (0.33) PLA2G7
SCHEMBL10734841 0.78 L3MBTL1 (0.34) PLA2G7L3MBTL1
SCHEMBL10656049 0.78 L3MBTL1 (0.33) L3MBTL1
SCHEMBL10618958 0.77 PLA2G7 (0.48) PLA2G7
SCHEMBL10618122 0.77 PLA2G7 (0.34) PLA2G7
SCHEMBL10618160 0.76 PLA2G7 (0.38) PLA2G7

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6417192-B1 DRUGS WITH PYRIMIDONE COMPOUNDS INHIBITORS OF THE ENZYME LDL PLA.SUB.2 AND THEREFORE OF USE IN TREATING ATHEROSCLEROSIS. SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-09 US disclosed
EP-0112707-B1 AMINOPYRIMIDINONE DERIVATIVES AS HISTAMINE H1-ANTAGONISTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1987-11-04 EP disclosed
US-4652650-A Pyridylaminoalkylamine intermediates SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1987-03-24 US disclosed
US-4639519-A 2-substituted alkylaminopyrimidones useful as H2 -antagonists and antiinflamatory agents SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1987-01-27 US disclosed
EP-0068833-B1 PYRIMIDINONE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-10-15 EP disclosed
EP-0068834-B1 PYRIMIDINONE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-09-03 EP disclosed
US-4584381-A HISTAMINE H1-ANTAGONIST SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-04-22 US disclosed
US-4558128-A ANTIHISTAMINE, ANTIINFLAMMATORY AGENT SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1985-12-10 US disclosed
US-4548940-A Pyridylaminoalkylaminopyrimidones useful as histamine H1 -antagonists SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1985-10-22 US disclosed
US-4535163-A ANTIHISTAMINES; PYRIMIDONE DERIVATIVES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1985-08-13 US disclosed
US-4444772-A 2-(3,5-DISUBSTITUTED-PYRIDYLALKYLAMINO)-5-PYRIDYLMETHYL-4 -PYRIMIDONE DERIVATIVES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1984-04-24 US disclosed
US-4439435-A PYRIMIDONE OR PYRIMID-THIONE DERIVATIVES, HISTAMINE ANTAGONIST, ANTIINFLAMMATORY SMITH KLINE & FRENCH LABORATORIES LTD. (GB) 1984-03-27 US disclosed
EP-0015138-B1 PYRIMIDONE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1983-03-16 EP disclosed
EP-0068834-A2 Pyrimidinone derivatives and pharmaceutical compositions containing them SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1983-01-05 EP disclosed
EP-0068833-A2 Pyrimidinone derivatives and pharmaceutical compositions containing them SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1983-01-05 EP disclosed
EP-0017680-B1 PYRIMIDONE DERIVATIVES, PROCESS FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1982-04-21 EP disclosed
US-4305945-A Isoureas and isothioureas SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1981-12-15 US disclosed
EP-0017680-A1 Pyrimidone derivatives, process for preparing them and pharmaceutical compositions containing them SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-10-29 EP disclosed
EP-0015138-A1 Pyrimidone derivatives, processes for their preparation and pharmaceutical compositions containing them SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-09-03 EP disclosed
EP-0007232-A1 Iso(thio)ureas, processes for their preparation and compositions containing them SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-01-23 EP disclosed