Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.37 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28952769 | 0.88 | ALDH1A1 (0.50) | ALDH1A1MAPK1MAPTMAOASMN1; SMN2 | |
| SCHEMBL28344499 | 0.79 | ALDH1A1 (0.43) | ALDH1A1PLAUNOS1ALOX15MAPK1 | |
| SCHEMBL17161281 | 0.77 | ALOX5 (0.44) | ALDH1A1SLC22A2SLC22A1SLC22A3PLAU | |
| SCHEMBL17913029 | 0.77 | ALDH1A1 (0.41) | ALDH1A1SLC22A2SLC22A1SLC22A3PLAU | |
| SCHEMBL21777201 | 0.77 | MAPT (0.42) | ALDH1A1SLC22A2SLC22A1SLC22A3PLAU | |
| SCHEMBL713037 | 0.76 | ALDH1A1 (0.70) | ALDH1A1MAPTNPC1SMN1; SMN2 | |
| SCHEMBL15559295 | 0.73 | CES2 (0.41) | CYP2A6ALOX5MAPTMAOAMAOB | |
| SCHEMBL11382133 | 0.72 | CA1 (0.44) | ALDH1A1MAPK1MAPTMAOANPC1 | |
| SCHEMBL14697226 | 0.72 | SLC22A2 (0.42) | ALDH1A1SLC22A2SLC22A1SLC22A3MAPK1 | |
| SCHEMBL17913050 | 0.72 | NOS3 (0.42) | ALDH1A1IDO1NOS1MAPTMAOA |
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-2016111658-A1 | SYNTHESIS OF THIOSEMICARBAZONE DERIVATIVES COMPRISING SULPHONAMIDE GROUP WITH POTENTIAL ANTICONVULSANT ACTIVITY | IYIDOGAN AYSEGUL (TR) | 2016-07-14 | — | — | WO | claimed |
| WO-2025046420-A1 | COMPOUND TARGETING EGR-1 AND USE THEREOF FOR TREATMENT OF ATOPIC DERMATITIS | 주식회사 아제라메디 | 2025-03-06 | — | — | WO | disclosed |
| WO-2016111658-A1 | SYNTHESIS OF THIOSEMICARBAZONE DERIVATIVES COMPRISING SULPHONAMIDE GROUP WITH POTENTIAL ANTICONVULSANT ACTIVITY | IYIDOGAN AYSEGUL (TR) | 2016-07-14 | — | — | WO | disclosed |