SCHEMBL17490666

SCHEMBL17490666

CCCCOc1nc(N)c2[nH]c(=O)n(CCCCN(CC(C)(C)CNC)S(=O)(=O)c3cccc(C(=O)O)c3)c2n1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 19/20 0.52
▸ TLR8 Q9NR97 1/20 0.46

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
SCHEMBL2389818 0.92 TLR7 (0.52) TLR7TLR8
SCHEMBL2385776 0.87 TLR7 (0.61) TLR7TLR8
SCHEMBL2387720 0.83 TLR7 (0.52) TLR7TLR8
SCHEMBL2389803 0.82 TLR7 (0.54) TLR7TLR8
SCHEMBL12048715 0.82 TLR7 (0.62) TLR7
SCHEMBL2387060 0.82 TLR7 (0.58) TLR7
SCHEMBL2388328 0.82 TLR7 (0.53) TLR7TLR8
SCHEMBL12048758 0.81 TLR7 (0.65) TLR7
SCHEMBL2389142 0.81 TLR7 (0.55) TLR7TLR8
SCHEMBL2388302 0.79 TLR7 (0.57) TLR7

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-1728793-B1 9-SUBSTITUTED 8-OXOADENINE COMPOUND SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2016-02-03 — — EP disclosed
Send feedback