SCHEMBL4881714

SCHEMBL4881714

COCCc1nc2c(N)nc(C)c(C)c2n1CCCCCS(=O)(=O)Nc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.40
TLR8 Q9NR97 1/20 0.38

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
SCHEMBL5338703 0.86 TLR7 (0.42) TLR7TLR8
SCHEMBL4871680 0.86 TLR7 (0.37) TLR7TLR8
SCHEMBL4879922 0.86 TLR8 (0.44) TLR7TLR8
SCHEMBL4793379 0.85 TLR7 (0.42) TLR7TLR8
SCHEMBL4867490 0.84 TLR7 (0.50) TLR7TLR8
SCHEMBL4870128 0.84 TLR7 (0.39) TLR7TLR8
SCHEMBL4793946 0.84 TLR7 (0.37) TLR7TLR8
SCHEMBL4794370 0.83 TLR7 (0.38) TLR7TLR8
SCHEMBL4883559 0.83 TLR7 (0.40) TLR7TLR8
SCHEMBL4794069 0.83 TLR7 (0.43) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513524-A4 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2008-09-03 EP disclosed
EP-1513524-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2005-03-16 EP disclosed
WO-2003103584-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-18 WO disclosed