SCHEMBL6135818

SCHEMBL6135818

CCCCc1nc2c(N)nc3ccccc3c2n1CCCCN(CCCCn1c(CCCC)nc2c(N)nc3ccccc3c21)C(N)=O

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.71
TLR8 Q9NR97 3/20 0.71

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
SCHEMBL7218456 0.96 TLR7 (0.68) TLR7TLR8
SCHEMBL5616930 0.88 TLR7 (0.77) TLR7TLR8
SCHEMBL20284108 0.87 TLR7 (0.78) TLR7TLR8
SCHEMBL7499760 0.87 TLR7 (0.64) TLR7TLR8
SCHEMBL20623370 0.87 TLR7 (0.89) TLR7TLR8
SCHEMBL5129550 0.86 TLR7 (0.62) TLR7TLR8
SCHEMBL19435433 0.86 TLR7 (0.52) TLR7TLR8
SCHEMBL6135641 0.85 TLR7 (0.73) TLR7TLR8
SCHEMBL22061946 0.85 TLR7 (0.67) TLR7TLR8
SCHEMBL5359488 0.85 TLR7 (0.82) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1542688-A2 1H-IMIDAZO DIMERS 3M Innovative Properties Company (US) 2005-06-22 EP claimed
WO-2004028539-A2 1H-IMIDAZO DIMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-04-08 WO claimed
EP-1542688-A2 1H-IMIDAZO DIMERS 3M Innovative Properties Company (US) 2005-06-22 EP disclosed
WO-2004028539-A2 1H-IMIDAZO DIMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-04-08 WO disclosed