Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.68 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.58 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.58 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL21275482 | 1.00 | PPARG (0.68) | PPARGADORA3SLC22A2SLC22A1ALDH1A1 | |
| SCHEMBL30002873 | 0.96 | PPARG (0.71) | PPARGADORA3SLC22A2SLC22A1ALDH1A1 | |
| SCHEMBL21275449 | 0.96 | PPARG (0.71) | PPARGADORA3SLC22A2SLC22A1ALDH1A1 | |
| SCHEMBL5792138 | 0.84 | ABCG2 (0.74) | PPARGADORA3SLC22A2SLC22A1ALDH1A1 | |
| SCHEMBL30002854 | 0.84 | ABCG2 (0.74) | PPARGADORA3SLC22A2SLC22A1ALDH1A1 | |
| SCHEMBL22773478 | 0.81 | PPARG (0.58) | PPARGADORA3SLC22A2SLC22A1CYP1A2 | |
| SCHEMBL30002869 | 0.80 | ABCG2 (0.74) | PPARGADORA3SLC22A2SLC22A1ALDH1A1 | |
| SCHEMBL21275469 | 0.80 | ABCG2 (0.74) | PPARGADORA3SLC22A2SLC22A1ALDH1A1 | |
| SCHEMBL7545480 | 0.79 | PPARG (0.70) | PPARGADORA3SLC22A2SLC22A1ALDH1A1 | |
| SCHEMBL16151312 | 0.79 | PPARG (0.71) | PPARGADORA3SLC22A2SLC22A1ABCG2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4322940-A1 | SYNTHETIC ROCAGLATES WITH BROAD-SPECTRUM ANTIVIRAL ACTIVITIES AND USES THEREOF | Memorial Sloan-Kettering Cancer Center (US) | 2024-02-21 | — | — | EP | disclosed |
| WO-2022221519-A1 | SYNTHETIC ROCAGLATES WITH BROAD-SPECTRUM ANTIVIRAL ACTIVITIES AND USES THEREOF | MEMORIAL SLOAN-KETTERING CANCER CENTER (US) | 2022-10-20 | — | — | WO | disclosed |