SCHEMBL20106769

SCHEMBL20106769

Nc1nc([S+]([O-])CCCCl)nc2c1[nH]c(=O)n2Cc1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.52
NUDT1 P36639 1/20 0.46
TLR8 Q9NR97 1/20 0.44

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
SCHEMBL20106823 0.92 TLR7 (0.60) TLR7NUDT1
SCHEMBL20106767 0.91 TLR7 (0.55) TLR7NUDT1TLR8
SCHEMBL20106981 0.90 TLR7 (0.56) TLR7NUDT1TLR8
SCHEMBL18207646 0.90 TLR7 (0.62) TLR7TLR8
SCHEMBL20107052 0.88 TLR7 (0.54) TLR7NUDT1TLR8
SCHEMBL18207273 0.87 TLR7 (0.63) TLR7NUDT1
SCHEMBL18207665 0.87 TLR7 (0.60) TLR7TLR8
SCHEMBL18207465 0.82 TLR7 (0.64) TLR7NUDT1
SCHEMBL20106966 0.82 TLR7 (0.54) TLR7NUDT1TLR8
SCHEMBL18207289 0.81 TLR7 (0.65) TLR7NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018078149-A1 NOVEL CYCLICSULFONIMIDOYLPURINONE COMPOUNDS AND DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF VIRUS INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2018-05-03 WO disclosed