SCHEMBL8546382

SCHEMBL8546382

CCCCOCC[C@H](CCC)Nc1nc(N)nc(C)c1Cc1ccc(OCCCCC(C)(C)[Si](C)(C)O)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 15/20 0.59
TLR8 Q9NR97 10/20 0.54

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
SCHEMBL8527410 0.88 TLR7 (0.69) TLR7TLR8
SCHEMBL8891502 0.87 TLR7 (0.64) TLR7TLR8
SCHEMBL8527802 0.85 TLR7 (0.68) TLR7TLR8
SCHEMBL8893974 0.85 TLR7 (0.66) TLR7TLR8
SCHEMBL8889574 0.83 TLR7 (0.65) TLR7TLR8
SCHEMBL8892620 0.82 TLR7 (0.67) TLR7TLR8
SCHEMBL8891573 0.81 TLR7 (0.62) TLR7TLR8
SCHEMBL8547814 0.80 TLR7 (0.43) TLR7
SCHEMBL16616705 0.80 TLR7 (0.69) TLR7TLR8
SCHEMBL16616706 0.80 TLR7 (0.69) TLR7TLR8

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-2012066335-A1 PHENOL COMPOUNDS ALS TOLL -LIKE RECEPTOR 7 AGONISTS ASTRAZENECA AB (SE) 2012-05-24 WO disclosed