Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19122660 | 0.88 | ACHE (0.34) | HRH3ACHESMN1; SMN2SIGMAR1 | |
| SCHEMBL24171459 | 0.84 | GNAO1 (0.42) | HRH3ACHESIGMAR1 | |
| SCHEMBL22856146 | 0.84 | ACHE (0.40) | HRH3ACHESMN1; SMN2HSD11B1 | |
| SCHEMBL25883021 | 0.82 | HRH3 (0.39) | HRH3ACHESMN1; SMN2HSD11B1ALDH1A1 | |
| SCHEMBL31273888 | 0.82 | HRH3 (0.49) | HRH3SMN1; SMN2HSD11B1 | |
| SCHEMBL23560074 | 0.81 | HRH3 (0.38) | HRH3ACHESMN1; SMN2HSD11B1ALDH1A1 | |
| SCHEMBL17753883 | 0.80 | HRH3 (0.37) | HRH3ACHESMN1; SMN2HSD11B1ALDH1A1 | |
| SCHEMBL24171714 | 0.79 | PIK3CD (0.36) | HRH3ACHESMN1; SMN2SIGMAR1ALDH1A1 | |
| SCHEMBL24172020 | 0.78 | SIGMAR1 (0.32) | SIGMAR1 | |
| SCHEMBL11919257 | 0.78 | SMN1; SMN2 (0.41) | HRH3SMN1; SMN2HSD11B1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022002100-A1 | NOVEL BENZIMIDAZOLE COMPOUND | 微境生物医药科技(上海)有限公司 | 2022-01-06 | — | — | WO | disclosed |
| US-7378411-B2 | Substituted thienopyrimidinones as a mitotic kinesin inhibitor | MERCK & CO., INC. (US) | 2008-05-27 | — | — | US | disclosed |
| US-7262186-B2 | Substituted pyrazolo[3,4-d] pyrimidinones as a mitotic kinesin inhibitor | MERCK & CO., INC. (US) | 2007-08-28 | — | — | US | disclosed |
| US-7262187-B2 | Substituted oxazolo- and thizaolopyrimidinones as a mitotic kinesin inhibitor | MERCK & CO., INC. (US) | 2007-08-28 | — | — | US | disclosed |