Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 7/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8931175 | 0.98 | ALOX5 (0.33) | ALOX5PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL8536285 | 0.86 | ALOX5 (0.37) | ALOX5PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL8534407 | 0.86 | ALOX5 (0.33) | ALOX5PTGS1PTGS2CYP1A2CYP3A4 | |
| Alcohol SCHEMBL8867372 | 0.84 | ALOX5 (0.36) | ALOX5PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL8931167 | 0.81 | PTGS1 (0.31) | ALOX5PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL8534319 | 0.78 | MAPT (0.31) | — | |
| SCHEMBL5671986 | 0.77 | PTGS1 (0.31) | ALOX5PTGS1PTGS2CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL8931178 | 0.77 | MAPT (0.30) | — | |
| SCHEMBL13592378 | 0.76 | ALOX5 (0.39) | ALOX5PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL8532916 | 0.75 | CYP3A4 (0.31) | PTGS1PTGS2CYP1A2CYP3A4TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0635009-B1 | NOVEL DERIVATIVES OF 2,3-DIHYDRO-2,2,4,6,7-PENTAALKYL-5-BENZOFURANOLS | MERRELL PHARMA INC (US) | 1997-09-17 | — | — | EP | claimed |
| US-5721233-A | Derivatives of 2,3-dihydro benzofuranols | MERRELL PHARMACEUTICALS INC. (US) | 1998-02-24 | — | — | US | disclosed |
| EP-0635009-B1 | NOVEL DERIVATIVES OF 2,3-DIHYDRO-2,2,4,6,7-PENTAALKYL-5-BENZOFURANOLS | MERRELL PHARMA INC (US) | 1997-09-17 | — | — | EP | disclosed |
| EP-0635009-A1 | NOVEL DERIVATIVES OF 2,3-DIHYDRO-2,2,4,6,7-PENTAALKYL-5-BENZOFURANOLS. | MERRELL DOW PHARMA (US) | 1995-01-25 | — | — | EP | disclosed |
| WO-1993020057-A1 | NOVEL DERIVATIVES OF 2,3-DIHYDRO-2,2,4,6,7-PENTAALKYL-5-BENZOFURANOLS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-10-14 | — | — | WO | disclosed |