Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.51 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.39 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.39 |
| ▸ | UGT2B7 | P16662 | 2/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL25666845 | 1.00 | ALDH1A1 (0.57) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL13987815 | 1.00 | ALDH1A1 (0.57) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL10524433 | 0.87 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL4351885 | 0.87 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL10524625 | 0.87 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL15494524 | 0.87 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL14356925 | 0.87 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL12234283 | 0.87 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL9880747 | 0.87 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| Acetic Acid SCHEMBL8957441 | 0.85 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-11572352-B2 | Method for producing sclareolide | SYMRISE AG (DE) | 2023-02-07 | — | — | US | disclosed |
| US-20210300885-A1 | METHOD FOR PRODUCING SCLAREOLIDE | SYMRISE AG (DE) | 2021-09-30 | — | — | US | disclosed |