Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL9031664 | 1.00 | NR1H2 (0.34) | NR1H2ALDH1A1KMT2AHRH3MAPK1 | |
| SCHEMBL9031668 | 1.00 | NR1H2 (0.34) | NR1H2ALDH1A1KMT2AHRH3MAPK1 | |
| SCHEMBL9031661 | 1.00 | NR1H2 (0.34) | NR1H2ALDH1A1KMT2AHRH3MAPK1 | |
| SCHEMBL9030846 | 0.87 | ALDH1A1 (0.35) | ALDH1A1KMT2AHRH3 | |
| SCHEMBL9031864 | 0.87 | ALDH1A1 (0.35) | ALDH1A1KMT2AHRH3 | |
| SCHEMBL9030853 | 0.87 | ALDH1A1 (0.35) | ALDH1A1KMT2AHRH3 | |
| SCHEMBL9030842 | 0.87 | ALDH1A1 (0.35) | ALDH1A1KMT2AHRH3 | |
| SCHEMBL9034069 | 0.85 | ALDH1A1 (0.33) | ALDH1A1KMT2AHRH3MAPK1 | |
| SCHEMBL9034074 | 0.85 | ALDH1A1 (0.33) | ALDH1A1KMT2AHRH3MAPK1 | |
| SCHEMBL9034071 | 0.85 | ALDH1A1 (0.33) | ALDH1A1KMT2AHRH3MAPK1 |
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-0558287-B1 | Tetrahydrothiophene derivatives | SANTEN PHARMACEUTICAL CO LTD (JP) | 1996-12-04 | — | — | EP | disclosed |
| US-5292767-A | Tetrahydrothiophene derivatives | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1994-03-08 | — | — | US | disclosed |
| EP-0558287-A1 | Tetrahydrothiophene derivatives | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1993-09-01 | — | — | EP | disclosed |