Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 3/20 | 0.53 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.53 |
| ▸ | CD274 | Q9NZQ7 | 4/20 | 0.53 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.53 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | APP | P05067 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22757791 | 0.90 | CD274 (0.57) | CD274PDCD1MAOBAPPNPC1 | |
| SCHEMBL20539163 | 0.82 | CD274 (0.46) | FFAR1FFAR4CD274PDCD1MAOB | |
| SCHEMBL21738369 | 0.78 | CD274 (0.46) | FFAR1FFAR4CD274PDCD1 | |
| SCHEMBL13366126 | 0.76 | CD274 (0.47) | FFAR1FFAR4CD274PDCD1APP | |
| SCHEMBL5512106 | 0.76 | APP (0.67) | FFAR1MAOBAPPNPC1POLB | |
| SCHEMBL1520607 | 0.74 | ABL1 (0.56) | FFAR1FFAR4CD274PDCD1RAB9A | |
| SCHEMBL23495565 | 0.74 | MAPT (0.56) | FFAR1MAOBAPPNPC1POLB | |
| SCHEMBL15743720 | 0.74 | ABL1 (0.59) | CD274PDCD1APPNPC1RAB9A | |
| SCHEMBL20000873 | 0.73 | APP (0.80) | FFAR1MAOBAPPNPC1POLB | |
| SCHEMBL4941492 | 0.73 | MMP2 (0.58) | FFAR1FFAR4CD274PDCD1SMN1; SMN2 |
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 3 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 |
| 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 |