Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | AXL | P30530 | 1/20 | 0.40 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL28162873 | 0.86 | ALDH1A1 (0.45) | ALDH1A1FKBP5NR4A2DAONPC1 | |
| Quinoline SCHEMBL27896103 | 0.82 | ALDH1A1 (0.61) | ALDH1A1NR4A2DAONPC1POLB | |
| SCHEMBL3350208 | 0.79 | FKBP5 (0.53) | ALDH1A1FKBP5DAONPC1AXL | |
| Quinoline SCHEMBL27319315 | 0.79 | ALDH1A1 (0.74) | ALDH1A1NR4A2DAONPC1POLB | |
| Quinoline SCHEMBL5567268 | 0.79 | ALDH1A1 (0.74) | ALDH1A1NR4A2DAONPC1POLB | |
| Quinoline SCHEMBL29349552 | 0.78 | ALDH1A1 (1.00) | ALDH1A1NR4A2NPC1POLBRAB9A | |
| Quinoline SCHEMBL2774 | 0.78 | ALDH1A1 (1.00) | ALDH1A1NR4A2NPC1POLBRAB9A | |
| Quinoline SCHEMBL32661377 | 0.78 | ALDH1A1 (1.00) | ALDH1A1NR4A2NPC1POLBRAB9A | |
| Quinoline SCHEMBL29822171 | 0.78 | ALDH1A1 (1.00) | ALDH1A1NR4A2NPC1POLBRAB9A | |
| Quinoline SCHEMBL1270969 | 0.78 | ALDH1A1 (1.00) | ALDH1A1NR4A2NPC1POLBRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023220559-A2 | CATALYST-CONTROLLED SITE-SELECTIVE METHYLENE C-H LACTONIZATION OF DICARBOXYLIC ACIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2023-11-16 | — | — | WO | claimed |
| WO-2024091806-A1 | INTERMOLECULAR BETA-METHYLENE C-H ARYLATION OF FREE ALIPHATIC ACIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2024-05-02 | — | — | WO | disclosed |
| WO-2023220559-A2 | CATALYST-CONTROLLED SITE-SELECTIVE METHYLENE C-H LACTONIZATION OF DICARBOXYLIC ACIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2023-11-16 | — | — | WO | disclosed |