SCHEMBL4666608

SCHEMBL4666608

CCCCOc1nc(N)c2[nH]c(=O)n(CCCN(CCCN3CCN(C)CC3)Cc3cccc(OC(C)=O)c3)c2n1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.61
IL6 P05231 2/20 0.53

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
SCHEMBL2840336 0.94 TLR7 (0.66) TLR7IL6
SCHEMBL4634229 0.91 TLR7 (0.53) TLR7
SCHEMBL4633208 0.91 TLR7 (0.53) TLR7
SCHEMBL5964498 0.90 TLR7 (0.64) TLR7IL6
SCHEMBL4634184 0.90 TLR7 (0.57) TLR7IL6
SCHEMBL4132555 0.89 TLR7 (0.63) TLR7IL6
SCHEMBL9936590 0.88 TLR7 (0.69) TLR7IL6
SCHEMBL1501678 0.88 TLR7 (0.65) TLR7IL6
SCHEMBL13798672 0.88 TLR7 (0.68) TLR7
SCHEMBL4131152 0.88 TLR7 (0.61) TLR7IL6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928876-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES AstraZeneca AB (SE) 2008-06-11 EP disclosed
WO-2007031726-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES ASTRAZENECA AB (SE) 2007-03-22 WO disclosed