Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 19/20 | 0.56 |
| ▸ | PDCD1 | Q15116 | 5/20 | 0.56 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22757792 | 0.93 | CD274 (0.52) | CD274PDCD1 | |
| SCHEMBL20539188 | 0.89 | CD274 (0.47) | CD274PDCD1 | |
| SCHEMBL20721107 | 0.85 | CD274 (0.65) | CD274PDCD1 | |
| SCHEMBL22758040 | 0.84 | PDCD1 (0.80) | CD274PDCD1 | |
| SCHEMBL19897846 | 0.83 | CD274 (0.54) | CD274PDCD1 | |
| SCHEMBL31166742 | 0.83 | TRIM24 (0.52) | — | |
| SCHEMBL19911757 | 0.82 | CD274 (0.49) | CD274PDCD1 | |
| SCHEMBL20540186 | 0.81 | CD274 (0.54) | CD274PDCD1 | |
| SCHEMBL22758047 | 0.80 | PDCD1 (0.73) | CD274PDCD1 | |
| SCHEMBL21130502 | 0.80 | CD274 (0.50) | CD274PDCD1 |
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-112028870-B | Compound with benzyloxy aromatic ring structure, preparation method and application thereof | 中国科学院上海药物研究所 | 2021-11-05 | — | — | CN | disclosed |
| WO-2020244518-A1 | COMPOUND WITH BENZYLOXY AROMATIC RING STRUCTURE, PREPARATION METHOD AND USE THEREOF | 中国科学院上海药物研究所 | 2020-12-10 | — | — | WO | disclosed |
| WO-2020244518-A1 | COMPOUND WITH BENZYLOXY AROMATIC RING STRUCTURE, PREPARATION METHOD AND USE THEREOF | 中国科学院上海药物研究所 | 2020-12-10 | — | — | WO | disclosed |
| CN-112028870-A | Compound with benzyloxy aromatic ring structure, preparation method and application thereof | 中国科学院上海药物研究所 | 2020-12-04 | — | — | CN | disclosed |