Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.65 |
| ▸ | AKR1B1 | P15121 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | TNKS | O95271 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.49 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.49 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7220795 | 0.84 | KDM4E (0.69) | KDM4EAKR1B1ALDH1A1TNKSMAPT | |
| SCHEMBL3397825 | 0.83 | MAPT (0.68) | KDM4EALDH1A1TNKSMAPTLMNA | |
| SCHEMBL29463595 | 0.83 | MAPT (0.68) | KDM4EALDH1A1TNKSMAPTLMNA | |
| SCHEMBL4254491 | 0.80 | KDM4E (0.72) | KDM4EAKR1B1ALDH1A1MAPTLMNA | |
| SCHEMBL8119217 | 0.80 | AKR1B1 (0.74) | KDM4EAKR1B1ALDH1A1TNKSMAOB | |
| SCHEMBL29463588 | 0.79 | KDM4E (0.70) | KDM4EAKR1B1ALDH1A1MAPTLMNA | |
| SCHEMBL9635473 | 0.79 | KDM4E (0.70) | KDM4EAKR1B1ALDH1A1MAPTLMNA | |
| SCHEMBL8107875 | 0.79 | KDM4E (1.00) | KDM4EAKR1B1ALDH1A1TNKSMAPT | |
| SCHEMBL4252102 | 0.75 | KDM4E (0.64) | KDM4EAKR1B1ALDH1A1MAPTLMNA | |
| SCHEMBL8107014 | 0.75 | KDM4E (0.76) | KDM4EAKR1B1ALDH1A1MAPTMAOB |
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 |