SCHEMBL4246882

SCHEMBL4246882

CCOCc1nc2c(N)nc3cc(O)ccc3c2n1CC(C)(C)N(C(N)=O)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.59
TLR8 Q9NR97 14/20 0.59
NUDT1 P36639 1/20 0.55

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
SCHEMBL4252345 0.87 TLR7 (0.55) TLR7TLR8NUDT1
SCHEMBL4241225 0.86 TLR7 (0.52) TLR7TLR8NUDT1
SCHEMBL4248169 0.85 TLR7 (0.41) TLR7TLR8NUDT1
SCHEMBL1486698 0.83 TLR7 (0.81) TLR7TLR8NUDT1
SCHEMBL1486706 0.81 TLR7 (0.61) TLR7TLR8NUDT1
SCHEMBL1486783 0.81 TLR7 (0.57) TLR7TLR8NUDT1
SCHEMBL4246425 0.81 TLR7 (0.47) TLR7TLR8NUDT1
SCHEMBL1486686 0.81 TLR7 (0.61) TLR7TLR8NUDT1
SCHEMBL1486429 0.80 TLR7 (0.79) TLR7TLR8NUDT1
SCHEMBL24495895 0.80 TLR7 (0.68) TLR7TLR8NUDT1

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-1658076-A4 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2009-02-25 EP disclosed
EP-1658076-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2006-05-24 EP disclosed
WO-2005020999-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-03-10 WO disclosed