SCHEMBL20219539

SCHEMBL20219539

CCCCC(CC(C)O)Nc1nc(N)ncc1OC

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 12/20 0.46
▸ TLR8 Q9NR97 7/20 0.46
▸ KCNH2 Q12809 4/20 0.43

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
SCHEMBL13195109 1.00 TLR7 (0.46) TLR7TLR8KCNH2
SCHEMBL20413303 0.87 TLR7 (0.37) TLR7TLR8KCNH2
SCHEMBL13195694 0.87 TLR7 (0.54) TLR7TLR8KCNH2
SCHEMBL20219473 0.87 TLR7 (0.54) TLR7TLR8KCNH2
SCHEMBL13195729 0.87 TLR7 (0.54) TLR7TLR8KCNH2
SCHEMBL23472404 0.87 TLR7 (0.51) TLR7TLR8KCNH2
SCHEMBL19274277 0.87 TLR7 (0.48) TLR7TLR8KCNH2
SCHEMBL13195144 0.86 TLR7 (0.63) TLR7TLR8KCNH2
SCHEMBL19269139 0.86 TLR7 (0.63) TLR7TLR8KCNH2
SCHEMBL13195845 0.86 TLR7 (0.63) TLR7TLR8KCNH2

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-3330257-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS Janssen Sciences Ireland UC (IE) 2018-06-06 — — EP disclosed
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