Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | VEGFA | P15692 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.38 |
| ▸ | TBK1 | Q9UHD2 | 8/20 | 0.38 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.38 |
| ▸ | CCNK | O75909 | 1/20 | 0.38 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27031201 | 1.00 | PARP1 (0.43) | PARP1IDO1TDO2IDO2GPR119 | |
| SCHEMBL29930574 | 0.97 | IDO1 (0.44) | PARP1IDO1TDO2IDO2GPR119 | |
| SCHEMBL27031245 | 0.97 | IDO1 (0.44) | PARP1IDO1TDO2IDO2GPR119 | |
| SCHEMBL27031200 | 0.87 | DDB1 (0.36) | PARP1IDO1TDO2IDO2GPR119 | |
| SCHEMBL29930632 | 0.87 | DDB1 (0.36) | PARP1IDO1TDO2IDO2GPR119 | |
| SCHEMBL31289268 | 0.85 | GPR119 (0.36) | PARP1IDO1TDO2IDO2GPR119 | |
| SCHEMBL29930726 | 0.85 | DDB1 (0.39) | GPR119DDB1CRBN | |
| SCHEMBL29930722 | 0.85 | TBK1 (0.43) | IDO1TDO2IDO2GPR119CA12 | |
| SCHEMBL27031216 | 0.85 | DDB1 (0.39) | GPR119DDB1CRBN | |
| SCHEMBL29930514 | 0.84 | DDB1 (0.41) | GPR119DDB1CRBN |
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-4308559-A1 | BENZISOXAZOLE DERIVATIVES AND USES THEREOF | Novartis AG (CH) | 2024-01-24 | — | — | EP | disclosed |
| WO-2022195355-A1 | BENZISOXAZOLE DERIVATIVES AND USES THEREOF | NOVARTIS AG (CH) | 2022-09-22 | — | — | WO | disclosed |