SCHEMBL26362148

SCHEMBL26362148

CCCCOc1nc(NC(=O)OCCCCCC(CCC)Oc2nc(NC(=O)OC(C)(C)CC(CCC)Oc3nc(N)c4[nH]c(=O)n(Cc5ccc(CN6CCC(C7CCN(C(=O)[C@H](CCCCNC(=O)CON)NC(=O)OCc8ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(C)=O)C(C)C)cc8)CC7)CC6)cc5)c4n3)c3[nH]c(=O)n(Cc4ccc(CN5CCC(C6CCN(C(=O)[C@@H](N)CCCCNC(=O)CON)CC6)CC5)cc4)c3n2)c2[nH]c(=O)n(Cc3ccc(CN4CCC(C5CCN(C(=O)[C@@H](N)CCCCNC(=O)CON)CC5)CC4)cc3)c2n1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 16/20 0.33
▸ IL6 P05231 11/20 0.33
▸ MAP1LC3B Q9GZQ8 2/20 0.32
▸ BCHE P06276 1/20 0.30
▸ ACHE P22303 1/20 0.30

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
SCHEMBL26362151 0.89 TLR7 (0.36) TLR7IL6MAP1LC3B
SCHEMBL26348221 0.88 TLR7 (0.41) TLR7IL6
SCHEMBL29034538 0.78 TLR7 (0.43) TLR7IL6BCHEACHE
SCHEMBL26355513 0.78 TLR7 (0.43) TLR7IL6BCHEACHE
SCHEMBL26355527 0.78 TLR7 (0.43) TLR7IL6BCHEACHE
SCHEMBL26348223 0.78 TLR7 (0.42) TLR7IL6
SCHEMBL26348222 0.77 TLR7 (0.45) TLR7IL6
SCHEMBL26348220 0.76 TLR7 (0.52) TLR7IL6
SCHEMBL26347255 0.75 TLR7 (0.53) TLR7IL6
SCHEMBL26360251 0.74 TLR7 (0.44) TLR7IL6BCHEACHE

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
US-20230302150-A1 ANTIBODY-TLR AGONIST CONJUGATES, METHODS AND USES THEREOF AMBRX, INC. (US) 2023-09-28 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230302150-A1 ANTIBODY-TLR AGONIST CONJUGATES, METHODS AND USES THEREOF TLR3, TLR1, TLR9 TLR7 4/4885IL6 1194/4885MAP1LC3B 1381/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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