Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | GMNN | O75496 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | GLA | P06280 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
| ▸ | CETP | P11597 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | CXCR5 | P32302 | 2/20 | 0.31 |
| ▸ | CCR6 | P51684 | 2/20 | 0.31 |
| ▸ | BLM | P54132 | 2/20 | 0.31 |
| ▸ | UBE2N | P61088 | 2/20 | 0.31 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.31 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29109085 | 1.00 | ALDH1A1 (0.37) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL29109095 | 0.91 | ALDH1A1 (0.31) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL29109080 | 0.91 | ALDH1A1 (0.31) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL29109083 | 0.82 | — | — | |
| SCHEMBL29109093 | 0.82 | — | — | |
| SCHEMBL21967105 | 0.81 | ALDH1A1 (0.37) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL21967115 | 0.81 | ALDH1A1 (0.37) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL21967096 | 0.81 | ALDH1A1 (0.37) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL21967080 | 0.81 | ALDH1A1 (0.37) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL21967083 | 0.81 | ALDH1A1 (0.37) | ALDH1A1CNR1CNR2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110551009-B | Process for the preparation of (2E, 6Z) -2, 6-nonenal and (2E) -cis-6, 7-epoxy-2-nonenal | 信越化学工业株式会社 | 2023-10-20 | — | — | CN | disclosed |