SCHEMBL8893974

SCHEMBL8893974

CCCCOCC[C@H](CCC)Nc1nc(N)nc(C)c1Cc1ccc(OCCCNCCO)cc1OC

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 16/20 0.66
TLR8 Q9NR97 8/20 0.64

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
SCHEMBL8891049 0.94 TLR7 (0.64) TLR7TLR8
SCHEMBL6119033 0.94 TLR7 (0.74) TLR7TLR8
SCHEMBL6119020 0.94 TLR7 (0.74) TLR7TLR8
SCHEMBL8527410 0.93 TLR7 (0.69) TLR7TLR8
SCHEMBL6119142 0.92 TLR7 (0.74) TLR7TLR8
SCHEMBL6119064 0.92 TLR7 (0.74) TLR7TLR8
SCHEMBL8891502 0.92 TLR7 (0.64) TLR7TLR8
SCHEMBL6128927 0.92 TLR7 (0.69) TLR7TLR8
SCHEMBL6128928 0.92 TLR7 (0.69) TLR7TLR8
SCHEMBL6119331 0.88 TLR7 (0.76) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012067269-A1 AMINOALKOXYPHENYL COMPOUNDS AND THEIR USE IN THE TREATMENT OF DISEASE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-24 WO disclosed