SCHEMBL23274200

SCHEMBL23274200

CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN(C)CCCCCc1cc2c(s1)C=C(C(=O)N(CCC)Cc1ccc(CN(C)C)cc1)CC(N)=N2

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 20/20 0.40
▸ TLR7 Q9NYK1 3/20 0.38

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
SCHEMBL23289661 0.95 TLR8 (0.39) TLR8TLR7
SCHEMBL23273943 0.94 TLR8 (0.40) TLR8TLR7
SCHEMBL23289659 0.92 TLR8 (0.37) TLR8TLR7
SCHEMBL23289576 0.90 TLR8 (0.37) TLR8TLR7
SCHEMBL23289663 0.89 TLR8 (0.39) TLR8TLR7
SCHEMBL23274143 0.89 TLR8 (0.36) TLR8TLR7
SCHEMBL23274098 0.88 TLR8 (0.39) TLR8TLR7
SCHEMBL23289361 0.87 TLR8 (0.52) TLR8TLR7
SCHEMBL23274206 0.86 TLR8 (0.41) TLR8TLR7
SCHEMBL23273945 0.86 TLR8 (0.37) TLR8TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021081407-A1 THIENOAZEPINE IMMUNOCONJUGATES, AND USES THEREOF BOLT BIOTHERAPEUTICS, INC. (US) 2021-04-29 — — WO disclosed
WO-2021081402-A1 MACROMOLECULE-SUPPORTED THIENOAZEPINE COMPOUNDS, AND USES THEREOF BOLT BIOTHERAPEUTICS, INC. (US) 2021-04-29 — — WO disclosed
WO-2021081407-A1 THIENOAZEPINE IMMUNOCONJUGATES, AND USES THEREOF BOLT BIOTHERAPEUTICS, INC. (US) 2021-04-29 — — WO disclosed
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