Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 5/20 | 0.51 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.51 |
| ▸ | SCD | O00767 | 1/20 | 0.40 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.40 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | ARAF | P10398 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | NPY2R | P49146 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4692110 | 0.93 | HCRTR1 (0.51) | HCRTR1HCRTR2SCDKCNK3KCNK9 | |
| SCHEMBL4692704 | 0.91 | HCRTR1 (0.49) | HCRTR1HCRTR2KCNK3KCNK9P2RX7 | |
| SCHEMBL4693018 | 0.90 | NPY2R (0.47) | SCDSMN1; SMN2ALDH1A1MAPTNPY2R | |
| SCHEMBL4692715 | 0.89 | HCRTR1 (0.43) | HCRTR1HCRTR2KCNK3KCNK9P2RX7 | |
| SCHEMBL4694435 | 0.88 | P2RX7 (0.47) | HCRTR1HCRTR2KCNK3KCNK9P2RX7 | |
| SCHEMBL4695365 | 0.88 | BRAF (0.39) | HCRTR1HCRTR2RAF1ARAFBRAF | |
| SCHEMBL4692947 | 0.88 | CPS1 (0.41) | HCRTR1HCRTR2KCNK3KCNK9P2RX7 | |
| SCHEMBL4693167 | 0.87 | HCRTR1 (0.50) | HCRTR1HCRTR2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL4691185 | 0.87 | P2RX7 (0.43) | HCRTR1HCRTR2RAF1ARAFBRAF | |
| SCHEMBL4690182 | 0.86 | RBP4 (0.41) | HCRTR1HCRTR2RAF1ARAFBRAF |
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-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-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |