Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.33 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30982194 | 0.88 | IRAK4 (0.35) | ALDH1A1SMN1; SMN2GAAMAPTHPGD | |
| SCHEMBL26693606 | 0.80 | HSD17B10 (0.40) | ALDH1A1SMN1; SMN2GAAHPGDKDM4E | |
| SCHEMBL31447720 | 0.75 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2GAAMAPTHPGD | |
| SCHEMBL30204796 | 0.73 | HSD17B10 (0.42) | ALDH1A1GAAMAPTHPGDKDM4E | |
| SCHEMBL26694058 | 0.69 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2GAAHPGDKDM4E | |
| SCHEMBL30204305 | 0.67 | JMJD6 (0.43) | ALDH1A1SMN1; SMN2GAAMAPTKDM4E | |
| SCHEMBL14738044 | 0.67 | SSTR4 (0.43) | ALDH1A1SMN1; SMN2MAPTKDM4EATM | |
| SCHEMBL13266511 | 0.67 | KDM4E (0.57) | ALDH1A1SMN1; SMN2MAPTHPGDKDM4E | |
| SCHEMBL29277572 | 0.67 | TSHR (0.37) | ALDH1A1SMN1; SMN2GAAMAPTKDM4E | |
| SCHEMBL5030728 | 0.67 | TGFBR1 (0.45) | ALDH1A1SMN1; SMN2GAAMAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024153595-A1 | CHROMANE DERIVATIVES AS EGFR SELECTIVE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2024-07-25 | — | — | WO | disclosed |