Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.61 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.61 |
| ▸ | PDE4A | P27815 | 1/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.51 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | CASP1 | P29466 | 2/20 | 0.49 |
| ▸ | CASP7 | P55210 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 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 | |
|---|---|---|---|---|
| SCHEMBL31154359 | 1.00 | AKR1C3 (0.61) | AKR1C3AKR1C1PDE4APDE4BPDE4C | |
| SCHEMBL21679193 | 0.91 | NPC1 (0.57) | AKR1C3AKR1C1PDE4APDE4BPDE4C | |
| SCHEMBL20739690 | 0.89 | ALDH1A1 (0.50) | AKR1C3AKR1C1ALDH1A1KDM4ETSHR | |
| SCHEMBL13267179 | 0.84 | ALDH1A1 (0.55) | ALDH1A1KDM4ETSHRHSD17B10GAA | |
| SCHEMBL8370055 | 0.81 | ALDH1A1 (0.48) | ALDH1A1KDM4ETSHRHSD17B10GAA | |
| SCHEMBL2323857 | 0.81 | ALDH1A1 (0.51) | ALDH1A1KDM4ETSHRHSD17B10GAA | |
| SCHEMBL31154321 | 0.81 | AKR1C3 (0.65) | AKR1C3AKR1C1PDE4APDE4BPDE4C | |
| SCHEMBL31154367 | 0.81 | AKR1C3 (0.65) | AKR1C3AKR1C1PDE4APDE4BPDE4C | |
| SCHEMBL28625883 | 0.80 | AKR1C3 (0.78) | AKR1C3AKR1C1PDE4APDE4BPDE4C | |
| SCHEMBL2953801 | 0.78 | ALDH1A1 (0.51) | ALDH1A1KDM4ETSHRHSD17B10GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4662326-A1 | LIGAND-ENABLED TRANSANNULAR C-H FUNCTIONALIZATION OF CYCLOALKANE CARBOXYLIC ACIDS | The Scripps Research Institute (US) | 2025-12-17 | — | — | EP | claimed |
| WO-2024167810-A1 | LIGAND-ENABLED TRANSANNULAR C-H FUNCTIONALIZATION OF CYCLOALKANE CARBOXYLIC ACIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2024-08-15 | — | — | WO | claimed |
| EP-4662326-A1 | LIGAND-ENABLED TRANSANNULAR C-H FUNCTIONALIZATION OF CYCLOALKANE CARBOXYLIC ACIDS | The Scripps Research Institute (US) | 2025-12-17 | — | — | EP | disclosed |
| WO-2024167810-A1 | LIGAND-ENABLED TRANSANNULAR C-H FUNCTIONALIZATION OF CYCLOALKANE CARBOXYLIC ACIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2024-08-15 | — | — | WO | disclosed |