Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CCR5 | P51681 | 8/20 | 0.43 |
| ▸ | CCL5 | P13501 | 11/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4690543 | 0.88 | CCR5 (0.46) | ALDH1A1CCR5CCL5 | |
| Cyclopentane SCHEMBL4695474 | 0.85 | CCR5 (0.55) | CCR5 | |
| SCHEMBL4692822 | 0.81 | SMYD3 (0.46) | ALDH1A1CCR5CCL5 | |
| SCHEMBL5231685 | 0.81 | CCR5 (0.67) | MEN1KMT2ACCR5 | |
| SCHEMBL4691521 | 0.80 | MCL1 (0.45) | CCR5CCL5 | |
| SCHEMBL4694458 | 0.78 | CCR5 (0.53) | CCR5CCL5 | |
| SCHEMBL4690162 | 0.77 | SMN1; SMN2 (0.49) | CCR5CCL5 | |
| SCHEMBL4695378 | 0.77 | CCL5 (0.52) | CCR5CCL5 | |
| SCHEMBL4693123 | 0.77 | CCR5 (0.50) | ALDH1A1CCR5CCL5 | |
| SCHEMBL4692783 | 0.77 | CCR5 (0.60) | KMT2ACCR5CCL5 |
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-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | claimed |
| EP-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |