Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7203923 | 0.98 | CNR2 (0.47) | HPGDHTTCNR2ALDH1A1LMNA | |
| SCHEMBL7209476 | 0.90 | CA1 (0.39) | HPGDHTTCNR2ALDH1A1LMNA | |
| SCHEMBL7204703 | 0.87 | CNR2 (0.53) | HPGDHTTCNR2ALDH1A1LMNA | |
| SCHEMBL7205051 | 0.86 | LSS (0.46) | HPGDHTTCNR2ALDH1A1LMNA | |
| SCHEMBL5066740 | 0.85 | HPGD (0.42) | HPGDHTTCNR2ALDH1A1LMNA | |
| SCHEMBL7205298 | 0.81 | LSS (0.51) | ALDH1A1 | |
| SCHEMBL7205301 | 0.81 | LSS (0.51) | ALDH1A1 | |
| SCHEMBL7211522 | 0.81 | USP30 (0.44) | HPGDHTTCNR2ALDH1A1L3MBTL1 | |
| SCHEMBL6528893 | 0.80 | CA1 (0.43) | HPGDHTTCNR2ALDH1A1LMNA | |
| SCHEMBL7204735 | 0.80 | CA1 (0.43) | HPGDHTTCNR2ALDH1A1LMNA |
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-1311475-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-05-21 | — | — | EP | claimed |
| WO-2002014267-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-02-21 | — | — | WO | claimed |
| EP-1311475-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-05-21 | — | — | EP | disclosed |
| WO-2002014267-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-02-21 | — | — | WO | disclosed |