Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.33 |
| ▸ | GPR4 | P46093 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4693197 | 0.92 | USP2 (0.40) | SMN1; SMN2USP2L3MBTL1GPR119GPR4 | |
| SCHEMBL2960422 | 0.80 | USP2 (0.36) | SMN1; SMN2USP2ADORA1MEN1ALDH1A1 | |
| SCHEMBL741512 | 0.78 | USP2 (0.43) | SMN1; SMN2USP2GPR119ALDH1A1ATM | |
| SCHEMBL25034617 | 0.75 | USP2 (0.45) | SMN1; SMN2USP2GPR119ATM | |
| SCHEMBL6208321 | 0.74 | L3MBTL1 (0.40) | SMN1; SMN2L3MBTL1ALDH1A1GAA | |
| SCHEMBL2892960 | 0.72 | USP2 (0.47) | SMN1; SMN2USP2GPR119ATM | |
| SCHEMBL4690324 | 0.72 | USP2 (0.44) | SMN1; SMN2USP2 | |
| SCHEMBL18587326 | 0.71 | USP2 (0.46) | SMN1; SMN2USP2GPR119MEN1KMT2A | |
| Tetrabuthylammonium SCHEMBL6996827 | 0.71 | MMP13 (0.37) | TLR8SMN1; SMN2USP2GPR119GPR4 | |
| SCHEMBL27147762 | 0.71 | USP2 (0.41) | SMN1; SMN2USP2GPR119GPR4ATM |
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-1286967-A1 | CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LTD. (GB) | 2003-03-05 | — | — | EP | disclosed |
| WO-2001087838-A1 | CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LIMITED (GB) | 2001-11-22 | — | — | WO | disclosed |