Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VHL | P40337 | 1/20 | 0.44 |
| ▸ | ELOC | Q15369 | 1/20 | 0.44 |
| ▸ | ELOB | Q15370 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL67587 | 0.82 | VHL (0.54) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL30543398 | 0.82 | VHL (0.54) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL23977277 | 0.72 | VHL (0.44) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL10464 | 0.71 | MAPT (0.46) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL2262470 | 0.71 | NOTUM (0.48) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL29673147 | 0.71 | NOTUM (0.48) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL8296391 | 0.69 | VHL (0.44) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL6605520 | 0.69 | VHL (0.51) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL13890187 | 0.69 | VHL (0.51) | VHLELOCELOBKDM4EALDH1A1 | |
| SCHEMBL30888626 | 0.69 | VHL (0.56) | VHLELOCELOBKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108640901-B | Thiochroman-4-ketone thiosemicarbazone compound and preparation method and application thereof | 岭南师范学院 | 2020-04-28 | — | — | CN | claimed |
| CN-116496261-A | 4- (1H) -imidazole derivative and medical application thereof | 中国人民解放军军事科学院军事医学研究院 | 2023-07-28 | — | — | CN | disclosed |
| CN-108640901-B | Thiochroman-4-ketone thiosemicarbazone compound and preparation method and application thereof | 岭南师范学院 | 2020-04-28 | — | — | CN | disclosed |