Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 11/20 | 0.43 |
| ▸ | ENPP2 | Q13822 | 5/20 | 0.41 |
| ▸ | CCL5 | P13501 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4694200 | 0.89 | CCR5 (0.44) | CCR5KCNH2 | |
| SCHEMBL4696268 | 0.88 | CCR5 (0.39) | CCR5ENPP2KCNH2MEN1KMT2A | |
| SCHEMBL4696397 | 0.87 | CCR5 (0.48) | CCR5CCL5KCNH2 | |
| SCHEMBL4691344 | 0.87 | CCR5 (0.47) | CCR5CCL5KCNH2 | |
| SCHEMBL4694951 | 0.83 | CCR5 (0.48) | CCR5CCL5 | |
| SCHEMBL4694411 | 0.82 | CCR5 (0.45) | CCR5CCL5KCNH2 | |
| Cyclopropane SCHEMBL4691469 | 0.81 | CCR5 (0.48) | CCR5CCL5KCNH2 | |
| Cyclopentane SCHEMBL4696746 | 0.81 | CCR5 (0.48) | CCR5CCL5KCNH2 | |
| Cyclohexane SCHEMBL4695443 | 0.81 | CCR5 (0.48) | CCR5CCL5KCNH2 | |
| SCHEMBL4691909 | 0.81 | CCR5 (0.48) | CCR5CCL5KCNH2 |
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 6 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-A2 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-03-14 | — | — | EP | claimed |
| WO-2005121145-A2 | OCTAHYDRO-PYRROLO[3,4-C] DERIVATIVES AND THEIR USE AS ANTIVIRAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-12-22 | — | — | WO | claimed |
| EP-1871762-A2 | SUBTITUTED HETEROARYL CB1 ANTAGONISTS | NEUROGEN CORPORATION (US) | 2008-01-02 | — | — | EP | disclosed |
| EP-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |
| WO-2006113704-A2 | SUBTITUTED HETEROARYL CB1 ANTAGONISTS | NEUROGEN CORPORATION (US) | 2006-10-26 | — | — | WO | disclosed |