Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27565884 | 0.93 | TDP1 (0.62) | TDP1CXCR4SMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL28331255 | 0.93 | TDP1 (0.68) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28092916 | 0.93 | TDP1 (0.68) | TDP1 | |
| Tert-Butyl Formate SCHEMBL17956883 | 0.93 | TDP1 (0.68) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27473155 | 0.93 | TDP1 (0.68) | TDP1 | |
| Azepane SCHEMBL27758894 | 0.91 | TDP1 (0.59) | TDP1 | |
| Azepane SCHEMBL28320281 | 0.91 | TDP1 (0.59) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28147817 | 0.91 | TDP1 (0.59) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28256721 | 0.91 | TDP1 (0.65) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27722006 | 0.91 | TDP1 (0.65) | TDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116947767-A | Human norepinephrine transporter body weight uptake inhibitor and preparation method and application thereof | 黄淮学院 | 2023-10-27 | — | — | CN | disclosed |
| CN-115650935-A | High-purity preparation method of homopiperazine derivative | 山东新华制药股份有限公司 | 2023-01-31 | — | — | CN | disclosed |
| CN-107428731-A | Substituted 2-hydro-pyrazole derivatives as anti-cancer agents | 正大天晴药业集团股份有限公司 | 2017-12-01 | — | — | CN | disclosed |
| CN-105392788-A | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC | 2016-03-09 | — | — | CN | disclosed |