SCHEMBL30608946

SCHEMBL30608946

CCCC[C@H](CO)Nc1nc(N)nc2cc(F)c(F)cc12

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 8/20 0.67
▸ TLR7 Q9NYK1 3/20 0.67
▸ KCNH2 Q12809 12/20 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
SCHEMBL18109656 1.00 TLR8 (0.67) TLR8TLR7KCNH2
SCHEMBL18109655 1.00 TLR8 (0.67) TLR8TLR7KCNH2
SCHEMBL13975800 0.93 KCNH2 (0.63) TLR8TLR7KCNH2
SCHEMBL18605999 0.93 KCNH2 (0.63) TLR8TLR7KCNH2
SCHEMBL24384557 0.86 KCNH2 (0.85) TLR8TLR7KCNH2
SCHEMBL15502394 0.86 KCNH2 (0.85) TLR8TLR7KCNH2
SCHEMBL13975807 0.86 KCNH2 (0.85) TLR8TLR7KCNH2
SCHEMBL21325637 0.86 KCNH2 (0.85) TLR8TLR7KCNH2
SCHEMBL22806213 0.85 TLR8 (0.73) TLR8TLR7KCNH2
SCHEMBL19924220 0.85 KCNH2 (0.55) TLR8TLR7KCNH2

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
CN-112174960-B Toll-like receptor modulating 4, 6-diamino-pyrido [3,2-D ] pyrimidine compounds 吉利德科学公司 2023-10-10 — — CN disclosed
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