Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.42 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL22236194 | 0.84 | TRIM24 (0.53) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL4416309 | 0.76 | KMT2A (0.46) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL7941523 | 0.76 | KMT2A (0.46) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL727114 | 0.74 | TRIM24 (0.53) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL21925246 | 0.74 | TRIM24 (0.53) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL1655628 | 0.74 | TRIM24 (0.53) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL22320959 | 0.74 | TRIM24 (0.53) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL21925266 | 0.74 | TRIM24 (0.53) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL1655400 | 0.74 | TRIM24 (0.53) | KMT2ATRIM24TRIM33ALDH1A1CA1 | |
| SCHEMBL12522127 | 0.72 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8173846-B2 | Substituted cyclohexenones | FIRMENICH SA (CH) | 2012-05-08 | — | — | US | disclosed |