SCHEMBL29034699

SCHEMBL29034699

CCCCOc1nc(N)c2[nH]c(=O)n(Cc3ccc(CN4CCC(CCNC(=O)C(N)Cc5ccc(Cn6cc(CON)nn6)cc5)CC4)cc3)c2n1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 20/20 0.53
▸ IL6 P05231 13/20 0.53
▸ TLR8 Q9NR97 2/20 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
SCHEMBL26347310 1.00 TLR7 (0.53) TLR7IL6TLR8
SCHEMBL29034581 0.94 TLR7 (0.54) TLR7IL6TLR8
SCHEMBL26347317 0.94 TLR7 (0.54) TLR7IL6TLR8
SCHEMBL26347860 0.92 TLR7 (0.52) TLR7IL6TLR8
SCHEMBL29034542 0.92 TLR7 (0.52) TLR7IL6TLR8
SCHEMBL26347329 0.92 TLR7 (0.52) TLR7IL6TLR8
SCHEMBL29034543 0.91 TLR7 (0.58) TLR7IL6TLR8
SCHEMBL26347326 0.91 TLR7 (0.58) TLR7IL6TLR8
SCHEMBL29034563 0.89 TLR7 (0.59) TLR7IL6TLR8
SCHEMBL26347268 0.89 TLR7 (0.59) TLR7IL6TLR8

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-116457023-A antibody-TLR agonist conjugates, methods and uses thereof AMBRX公司 2023-07-18 — — CN disclosed
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