Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL5793444 | 0.88 | TSHR (0.41) | TDP1CA1FFAR3ALDH1A1TSHR | |
| SCHEMBL270073 | 0.88 | TSHR (0.41) | TDP1CA1FFAR3ALDH1A1TSHR | |
| Alcohol SCHEMBL8390981 | 0.82 | TSHR (0.38) | CA1ALDH1A1TSHR | |
| Acetic Acid SCHEMBL9655219 | 0.80 | FFAR3 (0.41) | TDP1CA1FFAR3ALDH1A1TSHR | |
| SCHEMBL9242463 | 0.77 | TDP1 (0.62) | TDP1FFAR3ALDH1A1TSHR | |
| SCHEMBL269836 | 0.77 | — | — | |
| SCHEMBL888827 | 0.77 | — | — | |
| SCHEMBL12388848 | 0.77 | — | — | |
| SCHEMBL1482996 | 0.76 | TSHR (0.44) | TDP1CA1TSHR | |
| SCHEMBL27492963 | 0.76 | CA1 (0.33) | CA1ALDH1A1TSHR |
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-1998002406-A1 | RECYCLE AND RECOVERY OF USEFUL PRODUCTS FROM HEAVY ALDOL BY-PRODUCTS | EXXON CHEMICAL PATENTS, INC. (US) | 1998-01-22 | — | — | WO | disclosed |