SCHEMBL3817865

SCHEMBL3817865

CCOCc1nc2c(N)nc3ccccc3c2n1CCNS(=O)(=O)C1=CC=CCC1=S

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 10/20 0.55
TLR7 Q9NYK1 19/20 0.53
NUDT1 P36639 1/20 0.51

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
SCHEMBL3821435 0.88 TLR7 (0.57) TLR8TLR7
SCHEMBL7249936 0.84 TLR8 (0.67) TLR8TLR7NUDT1
SCHEMBL3813408 0.83 TLR7 (0.59) TLR8TLR7
SCHEMBL728616 0.83 TLR7 (0.69) TLR8TLR7NUDT1
SCHEMBL3813290 0.82 TLR7 (0.55) TLR8TLR7
SCHEMBL726760 0.81 TLR8 (0.63) TLR8TLR7NUDT1
SCHEMBL3820436 0.80 TLR7 (0.53) TLR8TLR7
SCHEMBL728508 0.80 TLR8 (0.58) TLR8TLR7NUDT1
SCHEMBL3968461 0.78 TLR7 (0.76) TLR8TLR7NUDT1
SCHEMBL3832987 0.78 TLR7 (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1642580-B1 Sulfonamide substituted imidazoquinolines COLEY PHARM GROUP INC (US) 2009-08-19 EP claimed