SCHEMBL5317415

SCHEMBL5317415

[CH2]c1nc2c(N)nc3ccccc3c2n1CCCCNS(C)(=O)=O

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 16/20 0.76
TLR8 Q9NR97 13/20 0.48
TDP1 Q9NUW8 2/20 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
SCHEMBL3970054 0.88 TLR7 (0.78) TLR7TLR8TDP1
Cpg-52852 SCHEMBL29371102 0.87 TLR7 (1.00) TLR7TLR8
SCHEMBL728302 0.87 TLR7 (0.75) TLR7TLR8TDP1
Cpg-52852 SCHEMBL483385 0.87 TLR7 (1.00) TLR7TLR8
SCHEMBL2744306 0.86 TLR7 (0.83) TLR7TLR8
SCHEMBL3927223 0.85 TLR7 (0.73) TLR7TLR8
SCHEMBL29852269 0.85 TLR7 (0.85) TLR7TLR8
SCHEMBL483689 0.85 TLR7 (0.85) TLR7TLR8
SCHEMBL15104225 0.84 TLR7 (0.71) TLR7TLR8
SCHEMBL728467 0.84 TLR7 (0.84) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1851224-A2 HYDROXYALKYL SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2007-11-07 EP disclosed
WO-2006098852-A2 HYDROXYALKYL SUBSTITUTED IMIDAZOQUINOLINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-09-21 WO disclosed