Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.39 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20520209 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520266 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520211 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520272 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520291 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520225 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520206 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520265 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520240 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 | |
| SCHEMBL20520232 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYSLTR2CYSLTR1TRPA1SOAT1 |
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-0406169-A1 | 2,4-Dimethyl-6-s-alkyl-phenols | CIBA-GEIGY AG (CH) | 1991-01-02 | — | — | EP | disclosed |