Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 6/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | GLA | P06280 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | IGLV6-57 | P01721 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28440563 | 0.84 | AR (0.43) | ALDH1A1KDM4ELMNAHTTRECQL | |
| SCHEMBL22431636 | 0.82 | ALDH1A1 (0.50) | ALDH1A1KDM4ELMNAHTTRECQL | |
| SCHEMBL20839422 | 0.77 | ALDH1A1 (0.47) | ALDH1A1KDM4ELMNAHTTRECQL | |
| SCHEMBL30762895 | 0.77 | ALDH1A1 (0.47) | ALDH1A1KDM4ELMNAHTTRECQL | |
| SCHEMBL21630139 | 0.77 | ALDH1A1 (0.62) | ALDH1A1KDM4ELMNAHTTRECQL | |
| SCHEMBL30231772 | 0.76 | ALDH1A1 (0.74) | ALDH1A1KDM4ELMNAHPGDUSP2 | |
| SCHEMBL30231784 | 0.76 | KDM4E (0.67) | ALDH1A1KDM4ELMNARECQLHPGD | |
| SCHEMBL30231580 | 0.76 | AR (0.52) | ALDH1A1KDM4ELMNAHTTRECQL | |
| SCHEMBL30231545 | 0.76 | MAPT (0.57) | ALDH1A1KDM4ELMNAHPGDUSP2 | |
| SCHEMBL20839098 | 0.76 | ALDH1A1 (0.64) | ALDH1A1KDM4ELMNAHTTRECQL |
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-111386261-B | Coumarin derivatives, process for their preparation and their use in the treatment of cancer | 利德发现中心有限责任公司 | 2024-03-22 | — | — | CN | claimed |
| CN-111386261-A | Coumarin derivatives, preparation method thereof and application thereof in cancer treatment | 利德发现中心有限责任公司 | 2020-07-07 | — | — | CN | claimed |
| CN-111386261-B | Coumarin derivatives, process for their preparation and their use in the treatment of cancer | 利德发现中心有限责任公司 | 2024-03-22 | — | — | CN | disclosed |
| CN-111386261-A | Coumarin derivatives, preparation method thereof and application thereof in cancer treatment | 利德发现中心有限责任公司 | 2020-07-07 | — | — | CN | disclosed |