Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 9/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7378705 | 0.89 | NQO1 (0.39) | NQO1ALDH1A1 | |
| SCHEMBL7355500 | 0.89 | NQO1 (0.39) | NQO1NPC1ALDH1A1RAB9A | |
| SCHEMBL7354664 | 0.88 | NQO1 (0.38) | NQO1NPC1ALDH1A1RAB9A | |
| SCHEMBL7353594 | 0.88 | NQO1 (0.38) | NQO1NPC1ALDH1A1RAB9A | |
| SCHEMBL7348477 | 0.87 | NQO1 (0.39) | NQO1ALDH1A1 | |
| SCHEMBL7355225 | 0.86 | NQO1 (0.40) | NQO1ALDH1A1 | |
| SCHEMBL7350245 | 0.86 | NQO1 (0.40) | NQO1ALDH1A1 | |
| SCHEMBL7360478 | 0.86 | NQO1 (0.37) | NQO1 | |
| SCHEMBL7351391 | 0.86 | NQO1 (0.37) | NQO1ALDH1A1 | |
| SCHEMBL7356417 | 0.85 | NQO1 (0.36) | NQO1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0682663-B1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | UPJOHN CO (US) | 2001-04-18 | — | — | EP | claimed |
| EP-0682663-A1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1995-11-22 | — | — | EP | disclosed |
| WO-1994018188-A1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL[B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | THE UPJOHN COMPANY (US) | 1994-08-18 | — | — | WO | disclosed |