Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 1.00 |
| ▸ | NPC1 | O15118 | 2/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.55 |
| ▸ | HTT | P42858 | 5/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | CLK1 | P49759 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18857080 | 0.92 | KMT2A (0.84) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL20436785 | 0.87 | KMT2A (0.77) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL16273105 | 0.83 | KMT2A (0.71) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL2351953 | 0.83 | KMT2A (0.71) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL7063704 | 0.82 | KMT2A (0.70) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL27773636 | 0.79 | KMT2A (0.66) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL13969733 | 0.79 | KMT2A (0.66) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL11102761 | 0.79 | KMT2A (0.66) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL2352042 | 0.79 | NPC1 (0.65) | KMT2ANPC1ALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL20436788 | 0.79 | KMT2A (0.65) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 |
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-113307749-B | Method for synthesizing beta-ketosulfone derivative under mild condition and obtained beta-ketosulfone derivative | 佛山湘潭大学绿色智造研究院 | 2022-09-09 | — | — | CN | disclosed |
| CN-113307749-A | Method for synthesizing beta-ketosulfone derivative under mild condition and obtained beta-ketosulfone derivative | 佛山湘潭大学绿色智造研究院 | 2021-08-27 | — | — | CN | disclosed |