Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | STS | P08842 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2812506 | 0.87 | AKR1B1 (0.62) | KDM4EALDH1A1HSD11B1EPHX2SLC2A1 | |
| SCHEMBL8107875 | 0.82 | KDM4E (1.00) | KDM4EALDH1A1EPHX2SLC2A1AKR1B1 | |
| SCHEMBL2810641 | 0.81 | PIM1 (0.56) | KDM4EALDH1A1HSD11B1MAPTLMNA | |
| SCHEMBL1500205 | 0.80 | EPHX2 (0.54) | KDM4EALDH1A1HSD11B1EPHX2MAPT | |
| SCHEMBL1500319 | 0.80 | EPHX2 (0.50) | KDM4EALDH1A1HSD11B1EPHX2GAA | |
| SCHEMBL2083018 | 0.80 | SMN1; SMN2 (0.49) | KDM4EALDH1A1HSD11B1MAPTGAA | |
| SCHEMBL8107014 | 0.78 | KDM4E (0.76) | KDM4EALDH1A1SLC2A1AKR1B1MAPT | |
| SCHEMBL8107902 | 0.76 | KDM4E (0.72) | KDM4EALDH1A1SLC2A1AKR1B1MAPT | |
| SCHEMBL8119217 | 0.75 | AKR1B1 (0.74) | KDM4EALDH1A1AKR1B1GAAKMT2A | |
| SCHEMBL4254491 | 0.75 | KDM4E (0.72) | KDM4EALDH1A1SLC2A1AKR1B1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022036040-A1 | SYNTHESIS OF SMALL MOLECULES INSPIRED BY PHOMOXANTHONE A | WORCESTER POLYTECHNIC INSTITUTE (US) | 2022-02-17 | — | — | WO | disclosed |