Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 18/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.56 |
| ▸ | SIRT5 | Q9NXA8 | 3/20 | 0.56 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21601091 | 0.78 | SIRT1 (1.00) | SIRT1KMT2AMEN1 | |
| SCHEMBL21601055 | 0.78 | SIRT1 (1.00) | SIRT1KMT2ASIRT2SIRT5 | |
| SCHEMBL21601043 | 0.78 | SIRT1 (1.00) | SIRT1SIRT2SIRT5 | |
| SCHEMBL9197955 | 0.78 | SIRT1 (0.74) | SIRT1KMT2ASIRT2SIRT5 | |
| SCHEMBL21601056 | 0.77 | SIRT1 (1.00) | SIRT1KMT2ASIRT2SIRT5 | |
| SCHEMBL21601103 | 0.74 | SIRT1 (1.00) | SIRT1SIRT2SIRT5 | |
| SCHEMBL13848399 | 0.73 | KMT2A (0.73) | SIRT1KMT2AMEN1 | |
| SCHEMBL21601044 | 0.72 | SIRT1 (1.00) | SIRT1KMT2ASIRT2SIRT5 | |
| SCHEMBL21601086 | 0.72 | SIRT1 (1.00) | SIRT1KMT2ASIRT2SIRT5 | |
| SCHEMBL30023564 | 0.72 | SIRT1 (1.00) | SIRT1KMT2ASIRT2SIRT5 |
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-111094262-B | 1, 3-dioxane-4, 6-diketone compound, preparation method thereof, pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2022-12-20 | — | — | CN | disclosed |
| WO-2019242687-A1 | 1,3-DIOXANE-4,6-DIONE COMPOUND, AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF | 中国科学院上海药物研究所 | 2019-12-26 | — | — | WO | disclosed |