Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.43 |
| ▸ | QPCT | Q16769 | 1/20 | 0.43 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28874437 | 0.95 | CYP1A2 (0.44) | LMNAALDH1A1HTTTSHRL3MBTL1 | |
| SCHEMBL28874552 | 0.91 | LMNA (0.47) | LMNAALDH1A1HTTTSHRL3MBTL1 | |
| SCHEMBL28874398 | 0.91 | CYP1A2 (0.49) | LMNATSHRL3MBTL1SMN1; SMN2GSK3A | |
| SCHEMBL29878676 | 0.90 | VSIR (0.44) | LMNAALDH1A1HTTTSHRL3MBTL1 | |
| SCHEMBL28874447 | 0.90 | VSIR (0.44) | LMNAALDH1A1HTTTSHRL3MBTL1 | |
| SCHEMBL28874288 | 0.89 | BCHE (0.41) | LMNAALDH1A1HTTTSHRL3MBTL1 | |
| SCHEMBL28874444 | 0.87 | GSK3B (0.43) | LMNAALDH1A1TSHRL3MBTL1SMN1; SMN2 | |
| SCHEMBL28874291 | 0.86 | GSK3B (0.48) | LMNAALDH1A1HTTTSHRL3MBTL1 | |
| SCHEMBL28874466 | 0.85 | EPHX2 (0.44) | LMNAALDH1A1HTTTSHRL3MBTL1 | |
| SCHEMBL29878407 | 0.84 | LMNA (0.55) | LMNAALDH1A1HTTTSHRL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115124485-B | Sulfoxide-containing benzoxazole derivative, and preparation method and application thereof | 中国医学科学院药物研究所 | 2023-12-15 | — | — | CN | disclosed |
| CN-115124485-A | Benzoxazole derivatives containing sulfoxide as well as preparation method and application thereof | 中国医学科学院药物研究所 | 2022-09-30 | — | — | CN | disclosed |