Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JUN | P05412 | 3/20 | 0.71 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.71 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | FDPS | P14324 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16621556 | 0.89 | JUN (0.80) | JUNNFKB1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL21154681 | 0.84 | SMN1; SMN2 (0.61) | JUNNFKB1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL14571867 | 0.83 | NFKB1 (1.00) | JUNNFKB1KDM4EALDH1A1HPGD | |
| SCHEMBL5218481 | 0.82 | ALDH1A1 (0.76) | KDM4EALDH1A1SMN1; SMN2HPGDALOX15 | |
| SCHEMBL5218471 | 0.82 | ALDH1A1 (0.76) | KDM4EALDH1A1SMN1; SMN2HPGDALOX15 | |
| SCHEMBL31501092 | 0.82 | ALDH1A1 (0.76) | KDM4EALDH1A1SMN1; SMN2HPGDALOX15 | |
| SCHEMBL10951487 | 0.78 | EPHX2 (0.68) | JUNNFKB1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL10951481 | 0.78 | EPHX2 (0.68) | JUNNFKB1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL12723726 | 0.78 | KDM4E (0.55) | JUNNFKB1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL17122475 | 0.76 | TUBB1 (0.51) | JUNNFKB1KDM4EALDH1A1SMN1; SMN2 |
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-3150203-A1 | COMPOUNDS WITH (1E,6E)-1,7-BIS-(3,4- DIMETHOXYPHENYL)-4,4-DISSTITUTED-HEPA-1,6-DIENE-3,5-DI-ONE STRUCTURAL SCAFFOLD,THEIR BIOLOGICAL ACTIVITY, AND USES THEREOF | Allianz Pharmascience Ltd (TW) | 2017-04-05 | — | — | EP | disclosed |