Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 3/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8081741 | 0.78 | ENPP2 (0.44) | PTGS2EPHX2NR1H4PTGDR2ENPP2 | |
| SCHEMBL8077236 | 0.78 | ENPP2 (0.44) | PTGS2EPHX2NR1H4PTGDR2ENPP2 | |
| SCHEMBL8133933 | 0.72 | ENPP2 (0.48) | PTGS2EPHX2NR1H4ENPP2 | |
| SCHEMBL15836429 | 0.69 | PTGS2 (0.53) | MMP14PTGS2PTGDR2ENPP2 | |
| SCHEMBL2600037 | 0.69 | ESR1 (0.50) | PTGS2EPHX2NR1H4ENPP2 | |
| SCHEMBL8189822 | 0.68 | MMP14 (0.36) | GAAMMP14PTGS2ENPP2 | |
| SCHEMBL8189819 | 0.68 | MMP14 (0.36) | GAAMMP14PTGS2ENPP2 | |
| SCHEMBL29771215 | 0.68 | CA12 (0.50) | MMP14PTGS2MMP9MMP13 | |
| SCHEMBL18403162 | 0.68 | EPHX2 (0.40) | PTGS2EPHX2NR1H4ENPP2 | |
| SCHEMBL14462577 | 0.68 | ENPP2 (0.42) | PTGS2EPHX2NR1H4ENPP2 |
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-0863891-A1 | (METHYLSULFONYL)PHENYL-2-(5H)-FURANONES AS COX-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997014691-A1 | (METHYLSULFONYL)PHENYL-2-(5H)-FURANONES AS COX-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1997-04-24 | — | — | WO | disclosed |