SCHEMBL22347135

SCHEMBL22347135

CCCCOc1nc(N)c2[nH]c(=O)n(Cc3ccc(CN4CCC(CCNC(=O)CCCCNC(=N)N)CC4)cc3)c2n1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 20/20 0.58
▸ IL6 P05231 10/20 0.58
▸ TLR8 Q9NR97 4/20 0.52

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
SCHEMBL29475668 0.92 TLR7 (0.57) TLR7IL6TLR8
SCHEMBL26347721 0.91 TLR7 (0.64) TLR7IL6TLR8
SCHEMBL26359820 0.90 TLR7 (0.55) TLR7IL6TLR8
SCHEMBL26347767 0.89 TLR7 (0.56) TLR7IL6TLR8
SCHEMBL28656515 0.89 TLR7 (0.56) TLR7IL6TLR8
SCHEMBL26347756 0.89 TLR7 (0.60) TLR7IL6TLR8
SCHEMBL26347251 0.88 TLR7 (0.59) TLR7IL6TLR8
SCHEMBL26348096 0.88 TLR7 (0.59) TLR7IL6TLR8
SCHEMBL26347740 0.88 TLR7 (0.62) TLR7IL6TLR8
SCHEMBL22359263 0.88 TLR7 (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3923991-A1 COMPOSITIONS CONTAINING, METHODS AND USES OF ANTIBODY-TLR AGONIST CONJUGATES Ambrx, Inc. (US) 2021-12-22 — — EP disclosed
WO-2020168017-A1 COMPOSITIONS CONTAINING, METHODS AND USES OF ANTIBODY-TLR AGONIST CONJUGATES AMBRX, INC. (US) 2020-08-20 — — WO disclosed
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