SCHEMBL7714583

SCHEMBL7714583

Nc1ncc(Cc2cccnc2)c(=O)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 18/20 0.61
PNP P00491 1/20 0.60

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
SCHEMBL11542383 0.84 AOC3 (0.60) PLA2G7PNP
SCHEMBL10618910 0.79 PLA2G7 (0.71) PLA2G7
SCHEMBL10741582 0.77 PLA2G7 (0.55) PLA2G7PNP
SCHEMBL7007970 0.76 PLA2G7 (1.00) PLA2G7
SCHEMBL5206921 0.76 PLA2G7 (0.49) PLA2G7PNP
SCHEMBL5202767 0.76 PDE3B (0.47) PLA2G7PNP
Peldesine SCHEMBL61135 0.75 PNP (1.00) PNP
SCHEMBL11359143 0.75 PLA2G7 (0.53) PLA2G7PNP
SCHEMBL7012765 0.75 PLA2G7 (0.53) PLA2G7PNP
Peldesine SCHEMBL29364464 0.75 PNP (1.00) PNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6440965-B1 Substituted pyrimidine derivatives, their preparation and their use in the treatment of neurodegenerative or neurological disorders of the central nervous system KRENITSKY PHARMACEUTICALS, INC. 2002-08-27 US disclosed
EP-0004793-A2 2-nitro aminopyrimidone derivatives, a process for their preparation and their use to prepare 2-aminopyrimidone derivatives which have histamine H2-antagonist activity SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1979-10-17 EP disclosed