Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | DNMT1 | P26358 | 3/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | RXRB | P28702 | 1/20 | 0.31 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | GPR84 | Q9NQS5 | 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 | |
|---|---|---|---|---|
| SCHEMBL20375552 | 0.92 | DNMT1 (0.33) | ALDH1A1MAPTNR1H4DNMT1 | |
| SCHEMBL16889231 | 0.88 | — | — | |
| SCHEMBL16889235 | 0.87 | KDM4E (0.37) | ALDH1A1 | |
| SCHEMBL20375703 | 0.85 | ALDH1A1 (0.33) | ALDH1A1MAPTRXRARXRBSERPINE1 | |
| SCHEMBL20375704 | 0.84 | ALDH1A1 (0.33) | ALDH1A1MAPTRXRARXRBSERPINE1 | |
| SCHEMBL17013580 | 0.83 | KDM4E (0.34) | — | |
| SCHEMBL16889351 | 0.80 | KDM4E (0.31) | ALDH1A1MAPT | |
| SCHEMBL20375551 | 0.80 | RXRA (0.34) | ALDH1A1MAPTRXRARXRBSERPINE1 | |
| SCHEMBL16889557 | 0.79 | KDM4E (0.31) | — | |
| SCHEMBL20375931 | 0.79 | ALDH1A1 (0.31) | ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3345911-A1 | POLYCYCLIC AROMATIC COMPOUNDS AND THEIR USE AS ORGANIC DEVICE MATERIAL | Kwansei Gakuin Educational Foundation (JP) | 2018-07-11 | — | — | EP | disclosed |