⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29211823 | 1.00 | — | — | |
| Leucine SCHEMBL3160921 | 0.80 | SLC7A5 (0.86) | — | |
| SCHEMBL31036833 | 0.77 | SLC1A3 (0.47) | — | |
| Leucine SCHEMBL20362356 | 0.76 | — | — | |
| Leucine SCHEMBL8568060 | 0.76 | SLC7A5 (1.00) | — | |
| Leucine SCHEMBL25241602 | 0.76 | SLC7A5 (1.00) | — | |
| D-Leucine SCHEMBL9449950 | 0.76 | SLC7A5 (1.00) | — | |
| SCHEMBL2692807 | 0.76 | — | — | |
| SCHEMBL14508101 | 0.76 | — | — | |
| Leucine SCHEMBL2478164 | 0.76 | SLC7A5 (1.00) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118662649-A | Polypeptide-antigen conjugates with unnatural amino acids | VAXCYTE公司 | 2024-09-20 | — | — | CN | disclosed |
| CN-110366428-B | Polypeptide-antigen conjugates with unnatural amino acids | VAXCYTE公司 | 2024-05-17 | — | — | CN | disclosed |