Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 11/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.39 |
| ▸ | HRH1 | P35367 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7674336 | 0.69 | HTR6 (0.47) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6128169 | 0.69 | KMT2A (0.36) | SLC6A2SLC6A4SLC6A3ADRA2C | |
| SCHEMBL27370620 | 0.69 | CTSB (0.41) | SLC6A2SLC6A4SLC6A3ADRA2C | |
| SCHEMBL6422599 | 0.67 | USP2 (0.54) | SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL27661965 | 0.66 | ADRA2C (0.33) | SLC6A2SLC6A4SLC6A3ADRA2C | |
| SCHEMBL5175530 | 0.66 | CTSB (0.38) | SLC6A2SLC6A4SLC6A3ADRA2CKCNH2 | |
| SCHEMBL6745832 | 0.66 | CTSB (0.38) | SLC6A2SLC6A4SLC6A3ADRA2CKCNH2 | |
| SCHEMBL6749403 | 0.66 | GAA (0.41) | SLC6A2SLC6A4SLC6A3ADRA2CKCNH2 | |
| SCHEMBL3963174 | 0.66 | CTSB (0.41) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28258693 | 0.66 | TSHR (0.42) | SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100572375-C | Spiro-benzene and dioxole and as the application of CB1 antagonist | HOFFMANN LA ROCHE (CH) | 2009-12-23 | — | — | CN | disclosed |
| CN-1914189-A | Spiro-benzodioxoles and their use as CB1 antagonists | HOFFMANN LA ROCHE (CH) | 2007-02-14 | — | — | CN | disclosed |
| EP-1716132-A2 | SPIRO-BENZODIOXOLES AND THEIR USE AS CB1 ANTAGONISTS | F.HOFFMANN-LA ROCHE AG (CH) | 2006-11-02 | — | — | EP | disclosed |
| WO-2005075450-A2 | SPIRO-BENZODIOXOLES AND THEIR USE AS CB1 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-08-18 | — | — | WO | disclosed |