Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| 1,4-Butanediol SCHEMBL18007026 | 0.93 | SMN1; SMN2 (0.53) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| 1,4-Butanediol SCHEMBL9614932 | 0.90 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Ethylene Glycol SCHEMBL23388166 | 0.85 | TSHR (0.47) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Ethylene Glycol SCHEMBL5476239 | 0.85 | — | — | |
| 1,4-Butanediol SCHEMBL9614930 | 0.84 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| 1-Hexanol SCHEMBL8436853 | 0.82 | LMNA (0.72) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Propanol SCHEMBL11239060 | 0.81 | — | — | |
| Alcohol SCHEMBL9548516 | 0.81 | — | — | |
| SCHEMBL9004510 | 0.81 | — | — | |
| SCHEMBL16959 | 0.80 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002034704-A2 | HYDROXY-ALKANOIC ACID ESTER MONOMER COMPOSITIONS AND METHODS OF MAKING SAME | METABOLIX, INC. (US) | 2002-05-02 | — | — | WO | claimed |
| US-8148569-B1 | Guerbet citrate polyesters | SURFATECH CORPORATION (US) | 2012-04-03 | — | — | US | disclosed |
| EP-1216083-B1 | RECOVERY PROCESS FOR VOLATILE COMPOUNDS FROM SOLIDS IN AQUEOUS SOLUTION | DU PONT (US) | 2007-07-25 | — | — | EP | disclosed |
| US-6231976-B1 | BLENDS CONTAINING CYCLOHEXANEDIMETHANOL | EASTMAN CHEMICAL COMPANY | 2001-05-15 | — | — | US | disclosed |
| US-5225387-A | Hydroformylation | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1993-07-06 | — | — | US | disclosed |