Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL5413499 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| SCHEMBL22548286 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| SCHEMBL362583 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| SCHEMBL19569168 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| Benzyl Carbamate SCHEMBL27278367 | 0.78 | ALDH1A1 (0.68) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| SCHEMBL23817240 | 0.77 | ALDH1A1 (0.61) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| SCHEMBL25670286 | 0.77 | ALDH1A1 (0.61) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| SCHEMBL19650334 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| SCHEMBL27327716 | 0.77 | ALDH1A1 (0.66) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 | |
| Benzyl Carbamate SCHEMBL8592590 | 0.76 | ALDH1A1 (0.64) | ALDH1A1TDP1HCAR2MAPK1L3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4397674-A1 | CASPASE-2 INHIBITOR COMPOUNDS | Kintsugi Therapeutics S.L. (ES) | 2024-07-10 | — | — | EP | disclosed |