Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APAF1 | O14727 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 5/20 | 0.48 |
| ▸ | BCHE | P06276 | 3/20 | 0.48 |
| ▸ | CDC25A | P30304 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | ALDH2 | P05091 | 4/20 | 0.46 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.41 |
| ▸ | TUBB | P07437 | 3/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.41 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.41 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29011250 | 0.99 | APAF1 (0.53) | APAF1CES1BCHECDC25AALDH1A1 | |
| SCHEMBL29011251 | 0.94 | APAF1 (0.55) | APAF1CES1BCHECDC25AALDH1A1 | |
| SCHEMBL29011261 | 0.89 | ALDH3A1 (0.59) | CES1BCHECDC25AALDH1A1ALDH2 | |
| SCHEMBL29220369 | 0.88 | CES1 (0.61) | APAF1CES1BCHEALDH1A1ALDH2 | |
| SCHEMBL29011259 | 0.87 | ALDH3A1 (0.60) | CES1BCHEALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL4597640 | 0.84 | ALDH1A1 (0.64) | APAF1CES1CDC25AALDH1A1ALDH2 | |
| SCHEMBL29011260 | 0.82 | ALDH3A1 (0.62) | CES1BCHEALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL28533366 | 0.80 | ALDH3A1 (0.67) | CES1CDC25AALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL11149607 | 0.79 | CES1 (0.76) | CES1BCHECDC25AALDH1A1ALDH2 | |
| SCHEMBL9383842 | 0.79 | ALDH1A1 (0.48) | ALDH1A1 |
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-119735585-A | Novel substituted isatin-coumarin derivative and preparation method and application thereof | 广东医科大学 | 2025-04-01 | — | — | CN | disclosed |
| CN-118108654-B | Substituted isatin-ferulic acid ester derivative and preparation method and application thereof | 广东医科大学 | 2025-03-07 | — | — | CN | disclosed |
| CN-116217547-B | Substituted isatin-8-hydroxyquinoline derivative and preparation method and application thereof | 广东医科大学 | 2024-10-22 | — | — | CN | disclosed |
| CN-118108654-A | Substituted isatin-ferulic acid ester derivative and preparation method and application thereof | 广东医科大学 | 2024-05-31 | — | — | CN | disclosed |
| CN-116217547-A | Substituted isatin-8-hydroxyquinoline derivative and preparation method and application thereof | 广东医科大学 | 2023-06-06 | — | — | CN | disclosed |