Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.72 |
| ▸ | HPGD | P15428 | 7/20 | 0.72 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.58 |
| ▸ | RECQL | P46063 | 2/20 | 0.58 |
| ▸ | KLK7 | P49862 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL21629554 | 0.90 | ALDH1A1 (0.73) | ALDH1A1HPGDALDH2KDM4ERECQL | |
| SCHEMBL21629539 | 0.88 | ALDH1A1 (0.80) | ALDH1A1HPGDALDH2KDM4ERECQL | |
| SCHEMBL30231474 | 0.82 | ALDH2 (0.61) | ALDH1A1HPGDALDH2KDM4ERECQL | |
| SCHEMBL30228258 | 0.82 | ALDH2 (0.73) | ALDH1A1HPGDALDH2KDM4ERECQL | |
| SCHEMBL30228157 | 0.80 | ALDH2 (0.73) | ALDH1A1HPGDALDH2KDM4ERECQL | |
| SCHEMBL21629543 | 0.78 | ALDH1A1 (0.79) | ALDH1A1HPGDALDH2KDM4ERECQL | |
| SCHEMBL21629592 | 0.78 | ALDH1A1 (0.79) | ALDH1A1HPGDALDH2KDM4ERECQL | |
| SCHEMBL21629565 | 0.78 | ALDH1A1 (0.66) | ALDH1A1HPGDALDH2KDM4ERECQL | |
| SCHEMBL21629540 | 0.78 | ALDH1A1 (1.00) | ALDH1A1HPGDKDM4ERECQLLMNA | |
| SCHEMBL21629541 | 0.78 | ALDH1A1 (1.00) | ALDH1A1HPGDKDM4ERECQLLMNA |
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-3598972-A1 | 4-PHENYL-COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER | Lead Discovery Center GmbH (DE) | 2020-01-29 | — | — | EP | disclosed |