Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CASR | P41180 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9259995 | 0.78 | HTR2A (0.36) | ALDH1A1 | |
| SCHEMBL7492439 | 0.76 | ESR1 (0.54) | LMNACHRM1SLC6A2ADRA1AHTR2B | |
| SCHEMBL9835248 | 0.76 | TRPA1 (0.41) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL6832687 | 0.72 | SRC (0.33) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL8750365 | 0.71 | TRPA1 (0.43) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL28381315 | 0.71 | CHRNA7 (0.43) | TDP1ALDH1A1CYP2A6 | |
| SCHEMBL2235269 | 0.69 | TDP1 (0.46) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL1003317 | 0.69 | TRPA1 (0.45) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL19122345 | 0.69 | TRPA1 (0.45) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL9073224 | 0.68 | TRPA1 (0.41) | TDP1TP53TRPA1LMNACHRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0216127-B1 | 6-PHENOXYMETHYL-4-HYDROXYTETRAHYDROPYRAN-2-ONES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINES, PHARMACEUTICAL COMPOSITIONS AND INTERMEDIATES | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-09-26 | — | — | EP | disclosed |
| EP-0216127-A2 | 6-Phenoxymethyl-4-hydroxytetrahydropyran-2-ones, process for their preparation, their use as medicines, pharmaceutical compositions and intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-04-01 | — | — | EP | disclosed |