Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.49 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.49 |
| ▸ | PELI1 | Q96FA3 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9744878 | 0.80 | TTR (0.59) | TRPA1SLC5A1SLC5A2PTPN1MEN1 | |
| SCHEMBL9744884 | 0.80 | TTR (0.59) | TRPA1SLC5A1SLC5A2PTPN1MEN1 | |
| SCHEMBL9294051 | 0.79 | TRPA1 (0.63) | TRPA1PTPN1MAPTHNF4ATTR | |
| SCHEMBL9294048 | 0.79 | TRPA1 (0.63) | TRPA1PTPN1MAPTHNF4ATTR | |
| SCHEMBL27677458 | 0.79 | PTPN1 (0.76) | TRPA1SLC5A1SLC5A2PTPN1PELI1 | |
| SCHEMBL6229519 | 0.77 | SLC5A1 (0.61) | TRPA1SLC5A1SLC5A2PTPN1PELI1 | |
| SCHEMBL30358577 | 0.77 | SLC5A1 (0.61) | TRPA1SLC5A1SLC5A2PTPN1PELI1 | |
| SCHEMBL6229522 | 0.77 | SLC5A1 (0.61) | TRPA1SLC5A1SLC5A2PTPN1PELI1 | |
| SCHEMBL11289265 | 0.76 | PTPN1 (0.60) | TRPA1SLC5A1SLC5A2PTPN1PELI1 | |
| SCHEMBL5183571 | 0.76 | TRPA1 (0.53) | TRPA1SLC5A1SLC5A2PTPN1PELI1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116270577-A | Application of polysubstituted benzene compounds in preparation of medicines for treating cognitive impairment diseases, structure and preparation method | 中国医学科学院医药生物技术研究所 | 2023-06-23 | — | — | CN | disclosed |
| CN-116270576-A | Application of polysubstituted benzene compounds in preparation of medicines for treating cognitive impairment diseases, structure and preparation method | 中国医学科学院医药生物技术研究所 | 2023-06-23 | — | — | CN | disclosed |
| CN-113521048-B | Application of polysubstituted benzene compound in preparation of medicine for treating cognitive disorder diseases, structure and preparation method | 中国医学科学院医药生物技术研究所 | 2023-04-14 | — | — | CN | disclosed |
| CN-113521048-A | Application of polysubstituted benzene compound in preparation of medicine for treating cognitive disorder diseases, structure and preparation method | 中国医学科学院医药生物技术研究所 | 2021-10-22 | — | — | CN | disclosed |