Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | PDE4A | P27815 | 1/20 | 0.56 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.56 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.56 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL31454907 | 0.90 | CYP2C19 (0.54) | CYP2C19PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31454923 | 0.89 | CYP2C19 (0.55) | CYP2C19PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31454924 | 0.89 | ALDH1A1 (0.68) | CYP2C19PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31454934 | 0.88 | CYP2C19 (0.60) | CYP2C19ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL31454947 | 0.88 | CYP2C19 (0.60) | CYP2C19ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL31454862 | 0.88 | ALDH1A1 (0.59) | CYP2C19PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31454838 | 0.87 | CYP2C19 (0.69) | CYP2C19ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL31454893 | 0.86 | ALDH1A1 (0.60) | CYP2C19PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31454858 | 0.85 | ALDH1A1 (0.58) | CYP2C19PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31454984 | 0.78 | CYP2C19 (0.58) | CYP2C19PDE4BPDE4DALDH1A1KDM4E |
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-2025042896-A1 | DNA TOPOISOMERASE IIβ INHIBITORS | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2025-02-27 | — | — | WO | disclosed |