Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 3/20 | 0.37 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.33 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | GPR4 | P46093 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | MMP14 | P50281 | 1/20 | 0.32 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 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 | |
|---|---|---|---|---|
| SCHEMBL4690324 | 0.87 | USP2 (0.44) | MMP13ADAM17MMP2USP2SMN1; SMN2 | |
| Tetrabuthylammonium SCHEMBL28155000 | 0.76 | HPGD (0.50) | USP2SMN1; SMN2CNR2PDE4APDE4B | |
| Tetrabuthylammonium SCHEMBL28285724 | 0.76 | HPGD (0.47) | USP2SMN1; SMN2CNR2PDE4APDE4B | |
| Tetrabuthylammonium SCHEMBL28284119 | 0.75 | HPGD (0.52) | USP2SMN1; SMN2CNR2 | |
| SCHEMBL28675542 | 0.74 | USP2 (0.42) | MMP13ADAM17MMP2USP2SMN1; SMN2 | |
| SCHEMBL6229408 | 0.73 | MMP13 (0.35) | MMP13ADAM17MMP2USP2SMN1; SMN2 | |
| Tetrabuthylammonium SCHEMBL28155004 | 0.73 | USP2 (0.43) | USP2SMN1; SMN2SPHK1CNR2TLR8 | |
| SCHEMBL2892960 | 0.72 | USP2 (0.47) | MMP13ADAM17MMP2USP2SMN1; SMN2 | |
| SCHEMBL4692388 | 0.72 | USP2 (0.42) | MMP13ADAM17USP2SMN1; SMN2FGFR1 | |
| SCHEMBL4836593 | 0.72 | GPR4 (0.45) | USP2SMN1; SMN2SPHK1CNR2GPR4 |
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 |