Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 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 | |
|---|---|---|---|---|
| SCHEMBL6175595 | 0.76 | EGFR (0.35) | EGFRALDH1A1 | |
| SCHEMBL28548234 | 0.61 | HCAR2 (0.53) | HCAR3HCAR2CYP1A2ALDH1A1DHODH | |
| SCHEMBL17070911 | 0.60 | ALDH1A1 (0.40) | CYP1A2ALDH1A1 | |
| SCHEMBL6843663 | 0.60 | MEN1 (0.41) | CYP1A2ALDH1A1 | |
| SCHEMBL13716378 | 0.59 | CYP1A2 (0.45) | HCAR3HCAR2CYP1A2ALDH1A1DHODH | |
| SCHEMBL4352151 | 0.58 | CA2 (0.42) | HCAR3HCAR2CYP1A2ALDH1A1DHODH | |
| SCHEMBL1690392 | 0.58 | CHRM2 (0.37) | — | |
| SCHEMBL5679073 | 0.57 | MAPT (0.33) | ALDH1A1 | |
| SCHEMBL2804521 | 0.57 | ALDH1A1 (0.37) | CYP1A2ALDH1A1 | |
| SCHEMBL23214499 | 0.56 | HCAR2 (0.45) | HCAR3HCAR2CYP1A2EGFRALDH1A1 |
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-1203770-B1 | Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating hyperplasia and other diseases | UPJOHN CO (US) | 2005-03-09 | — | — | EP | claimed |
| EP-0668860-B1 | PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES | UPJOHN CO (US) | 2002-09-11 | — | — | EP | claimed |