SCHEMBL4878032

SCHEMBL4878032

CCOCc1nc2c(N)nc(C)c(C)c2n1CCCS(=O)(=O)NC

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 13/20 0.40
TLR7 Q9NYK1 19/20 0.37
NUDT1 P36639 1/20 0.36

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
SCHEMBL13914516 0.97 TLR8 (0.39) TLR8TLR7NUDT1
SCHEMBL4793853 0.89 TLR8 (0.42) TLR8TLR7NUDT1
SCHEMBL6773786 0.87 TLR7 (0.39) TLR8TLR7NUDT1
SCHEMBL5339393 0.86 TLR8 (0.40) TLR8TLR7NUDT1
SCHEMBL6777551 0.86 TLR7 (0.41) TLR8TLR7NUDT1
SCHEMBL4794708 0.86 TLR8 (0.41) TLR8TLR7NUDT1
SCHEMBL4311260 0.86 TLR8 (0.41) TLR8TLR7NUDT1
SCHEMBL4793746 0.85 TLR8 (0.41) TLR8TLR7NUDT1
SCHEMBL4873466 0.85 TLR7 (0.45) TLR8TLR7
SCHEMBL6285260 0.83 TLR7 (0.49) TLR8TLR7NUDT1

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