Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 13/20 | 0.36 |
| ▸ | CCND1 | P24385 | 13/20 | 0.36 |
| ▸ | CCND2 | P30279 | 13/20 | 0.36 |
| ▸ | CCND3 | P30281 | 13/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CCR9 | P51686 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.32 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.32 |
| ▸ | CDK1 | P06493 | 2/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.32 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.32 |
| ▸ | FGFR4 | P22455 | 2/20 | 0.32 |
| ▸ | FGFR3 | P22607 | 2/20 | 0.32 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.32 |
| ▸ | CDK2 | P24941 | 2/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.32 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28642853 | 0.79 | CDK4 (0.51) | CDK4CCND1CCND2CCND3CCNB2 | |
| SCHEMBL19211615 | 0.77 | PKM (0.36) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19211574 | 0.76 | CDK4 (0.44) | CDK4CCND1CCND2CCND3CCNB2 | |
| SCHEMBL19211593 | 0.76 | CDK4 (0.39) | CDK4CCND1CCND2CCND3KDM4E | |
| SCHEMBL19211604 | 0.74 | MAPT (0.37) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19212759 | 0.73 | CA1 (0.39) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL28263347 | 0.72 | KMT2A (0.46) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19212793 | 0.72 | MTNR1A (0.35) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19211564 | 0.71 | MTNR1A (0.35) | CDK4CCND1CCND2CCND3KDM4E | |
| SCHEMBL6720408 | 0.70 | CDK4 (0.47) | CDK4CCND1CCND2CCND3KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3413976-A1 | HETEROCYCLIC COMPOUNDS, IN PARTICULAR 2-OXO-4,4,5,5,6,6,7,7-OCTAHYDROBENZOXAZOLE DERIVATIVES, AND THEIR USE AS ANTIBACTERIAL COMPOUNDS | Redx Pharma PLC (GB) | 2018-12-19 | — | — | EP | disclosed |
| EP-3414246-A1 | ANTIBACTERIAL COMPOUNDS | Redx Pharma PLC (GB) | 2018-12-19 | — | — | EP | disclosed |
| WO-2017137743-A1 | ANTIBACTERIAL COMPOUNDS | REDX PHARMA PLC (GB) | 2017-08-17 | — | — | WO | disclosed |
| WO-2017137744-A1 | HETEROCYCLIC COMPOUNDS, IN PARTICULAR 2-OXO-4,4,5,5,6,6,7,7-OCTAHYDROBENZOXAZOLE DERIVATIVES, AND THEIR USE AS ANTIBACTERIAL COMPOUNDS | REDX PHARMA PLC (GB) | 2017-08-17 | — | — | WO | disclosed |