SCHEMBL2390785

SCHEMBL2390785

CCCCOc1nc(N)c2[nH]c(=O)n(CCCCN(C[C@@H](O)CO)S(=O)(=O)c3cccc(C(C)C(=O)O)c3)c2n1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.54
TLR8 Q9NR97 1/20 0.46

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
SCHEMBL2387870 0.90 TLR7 (0.58) TLR7
SCHEMBL2389142 0.90 TLR7 (0.55) TLR7TLR8
SCHEMBL2389806 0.90 TLR7 (0.52) TLR7TLR8
SCHEMBL2389757 0.89 TLR7 (0.58) TLR7
SCHEMBL2388760 0.88 TLR7 (0.59) TLR7TLR8
SCHEMBL2388328 0.88 TLR7 (0.53) TLR7TLR8
SCHEMBL5964303 0.88 TLR7 (0.48) TLR7TLR8
SCHEMBL12047492 0.87 TLR7 (0.62) TLR7
SCHEMBL2386573 0.85 TLR7 (0.62) TLR7
SCHEMBL2388884 0.82 TLR7 (0.61) TLR7

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
EP-1728793-B1 9-SUBSTITUTED 8-OXOADENINE COMPOUND SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2016-02-03 EP claimed
US-8012964-B2 9-substituted 8-oxoadenine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-09-06 US disclosed