Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 18/20 | 0.55 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.46 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18537881 | 0.92 | NR1H2 (0.53) | NR1H2NR1H3CA12CA9 | |
| SCHEMBL29781083 | 0.88 | NR1H2 (0.55) | NR1H2NR1H3CA12CA9 | |
| SCHEMBL7902953 | 0.88 | NR1H2 (0.55) | NR1H2NR1H3CA12CA9 | |
| SCHEMBL24894603 | 0.88 | NOD2 (0.62) | NR1H2NR1H3CA12CA9NOD2 | |
| SCHEMBL29827958 | 0.88 | NOD2 (0.62) | NR1H2NR1H3CA12CA9NOD2 | |
| SCHEMBL4251782 | 0.87 | NR1H2 (0.54) | NR1H2NR1H3CA12CA9 | |
| SCHEMBL29725642 | 0.87 | NR1H2 (0.54) | NR1H2NR1H3CA12CA9 | |
| SCHEMBL3852059 | 0.87 | NR1H2 (0.57) | NR1H2NR1H3CA12CA9 | |
| SCHEMBL5957852 | 0.83 | NR1H2 (0.51) | NR1H2NR1H3CA12CA9 | |
| SCHEMBL17022654 | 0.82 | NR1H2 (0.57) | NR1H2NR1H3CA12CA9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114728917-B | Oxamide derivative, preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-114728914-B | Dioxopiperazine derivative, preparation method thereof and application thereof in medicines | 深圳信立泰药业股份有限公司 | 2023-05-12 | — | — | CN | disclosed |
| CN-114728914-A | Dioxopiperazine derivative, preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-114728917-A | Oxamide derivative, preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-114206854-A | FXIa inhibitor and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2022-03-18 | — | — | CN | disclosed |