Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | STAT6 | P42226 | 1/20 | 0.35 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.34 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.33 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SPIN1 | Q9Y657 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22042474 | 0.77 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1NPSR1KDM4ESTAT6 | |
| SCHEMBL31092659 | 0.77 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1NPSR1KDM4ESTAT6 | |
| SCHEMBL23912554 | 0.68 | PTGS2 (0.36) | SMN1; SMN2ALDH1A1KDM4EPDE4APDE4B | |
| SCHEMBL26329960 | 0.67 | ALDH1A1 (0.47) | ALDH1A1NPSR1KDM4ESTAT6NTSR1 | |
| SCHEMBL23904946 | 0.66 | ALDH1A1 (0.49) | SMN1; SMN2ALDH1A1NPSR1KDM4EMEN1 | |
| SCHEMBL24226822 | 0.66 | TAAR1 (0.36) | SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL13082756 | 0.66 | PTGS2 (0.34) | SMN1; SMN2ALDH1A1KDM4EHPGD | |
| SCHEMBL31000090 | 0.64 | SMN1; SMN2 (0.53) | SMN1; SMN2ALDH1A1LRRK2KDM4EKMT2A | |
| SCHEMBL31000147 | 0.64 | PIK3CA (0.50) | SMN1; SMN2ALDH1A1LRRK2KDM4EKMT2A | |
| SCHEMBL13027673 | 0.62 | NOS1 (0.43) | SMN1; SMN2ALDH1A1LRRK2NPSR1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3892278-B1 | CYCLOALKANE-1,3-DIAMINE DERIVATIVE | DAIICHI SANKYO CO LTD (JP) | 2024-02-28 | — | — | EP | disclosed |
| EP-3892278-A1 | CYCLOALKANE-1,3-DIAMINE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2021-10-13 | — | — | EP | disclosed |