Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23457247 | 0.82 | TDP1 (0.44) | TDP1ALDH1A1PKM | |
| SCHEMBL19244567 | 0.73 | TDP1 (0.44) | TDP1ALDH1A1PKM | |
| SCHEMBL7756808 | 0.73 | TDP1 (0.44) | TDP1CYP3A4ALDH1A1PKM | |
| SCHEMBL23259359 | 0.67 | APLNR (0.59) | APLNRALDH1A1 | |
| SCHEMBL17344324 | 0.65 | NFE2L2 (0.44) | TDP1CYP3A4ALDH1A1 | |
| SCHEMBL29412411 | 0.64 | — | — | |
| SCHEMBL27812251 | 0.64 | TDP1 (0.40) | TDP1 | |
| SCHEMBL24052805 | 0.63 | ALDH1A1 (0.34) | HMGCRCYP3A4ALDH1A1 | |
| SCHEMBL194096 | 0.63 | — | — | |
| SCHEMBL29549708 | 0.63 | — | — |
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-4719386-A2 | 5,6 SATURATED BICYCLIC HETEROCYLES USEFUL AS INHIBITORS OF NOD-LIKE RECEPTOR PROTEIN 3 | Merck Sharp & Dohme LLC (US) | 2026-04-08 | — | — | EP | disclosed |
| EP-4656635-A1 | SUBSTITUTED BENZENE COMPOUND | Daiichi Sankyo Company, Limited (JP) | 2025-12-03 | — | — | EP | disclosed |
| WO-2024249389-A2 | 5,6 SATURATED BICYCLIC HETEROCYLES USEFUL AS INHIBITORS OF NOD-LIKE RECEPTOR PROTEIN 3 | MERCK SHARP & DOHME LLC (US) | 2024-12-05 | — | — | WO | disclosed |
| WO-2024157953-A1 | SUBSTITUTED BENZENE COMPOUND | 第一三共株式会社 | 2024-08-02 | — | — | WO | disclosed |