Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP46A1 | Q9Y6A2 | 10/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.57 |
| ▸ | PKLR | P30613 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.39 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29453812 | 1.00 | CYP46A1 (0.57) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL22719206 | 0.91 | CYP46A1 (0.60) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL29453726 | 0.91 | CYP46A1 (0.60) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL22728370 | 0.90 | CYP46A1 (0.44) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL29453798 | 0.89 | CYP46A1 (0.59) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL22719439 | 0.89 | CYP46A1 (0.59) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL22719409 | 0.89 | CYP46A1 (0.59) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL29453744 | 0.89 | CYP46A1 (0.59) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL22719457 | 0.87 | CYP3A4 (0.53) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 | |
| SCHEMBL29453789 | 0.87 | CYP3A4 (0.53) | CYP46A1CYP3A4CYP2C19CYP2C9CYP2C8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022261510-A1 | NEUROACTIVE STEROID FOR THE TREATMENT OF ALZHEIMER'S DISEASE | SAGE THERAPEUTICS, INC. (US) | 2022-12-15 | — | — | WO | disclosed |
| WO-2020243027-A1 | COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | SAGE THERAPEUTICS, INC. (US) | 2020-12-03 | — | — | WO | disclosed |
| WO-2020243027-A1 | COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | SAGE THERAPEUTICS, INC. (US) | 2020-12-03 | — | — | WO | disclosed |