Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | AOC2 | O75106 | 1/20 | 0.35 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3004965 | 1.00 | CA12 (0.39) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL2566829 | 0.92 | CA12 (0.43) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL15103285 | 0.90 | CYP2D6 (0.43) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL2410263 | 0.86 | ALDH1A1 (0.43) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL31076408 | 0.84 | CA12 (0.41) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL31662627 | 0.84 | CA12 (0.41) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL4035337 | 0.82 | CA12 (0.39) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL20129169 | 0.82 | ALDH1A1 (0.42) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL31662487 | 0.82 | CA12 (0.39) | CA12CA1CA9CYP2D6CYP1A2 | |
| SCHEMBL499873 | 0.81 | CYP2D6 (0.44) | CA12CA1CA9CYP2D6CYP1A2 |
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-2025149545-A1 | HETEROARYLPHENYL ETHER DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2025-07-17 | — | — | WO | disclosed |