Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.32 |
| ▸ | NPY1R | P25929 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.31 |
| ▸ | AXL | P30530 | 1/20 | 0.30 |
| ▸ | FLT3 | P36888 | 1/20 | 0.30 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.30 |
| ▸ | MERTK | Q12866 | 1/20 | 0.30 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
| ▸ | SRC | P12931 | 2/20 | 0.30 |
| ▸ | F10 | P00742 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30767443 | 1.00 | KCNH2 (0.33) | KCNH2MCHR1NAAAPARP1PARP2 | |
| SCHEMBL30767646 | 1.00 | KCNH2 (0.33) | KCNH2MCHR1NAAAPARP1PARP2 | |
| SCHEMBL31664973 | 0.93 | KCNH2 (0.34) | KCNH2MCHR1APPGRM2AXL | |
| SCHEMBL30767410 | 0.91 | GRM2 (0.34) | NPY1RGRM2 | |
| SCHEMBL30767545 | 0.87 | GRM2 (0.35) | KCNH2MCHR1APPGRM2AXL | |
| SCHEMBL30767323 | 0.87 | GRM2 (0.35) | KCNH2MCHR1APPGRM2AXL | |
| SCHEMBL30767334 | 0.87 | GRM2 (0.35) | KCNH2MCHR1APPGRM2AXL | |
| SCHEMBL31665008 | 0.87 | GRM2 (0.33) | NPY1RGRM2FAAHEPHX2 | |
| SCHEMBL30767615 | 0.87 | CNR1 (0.32) | KCNH2MCHR1PARP1PARP2FAAH | |
| SCHEMBL30767411 | 0.87 | CNR1 (0.32) | KCNH2MCHR1PARP1PARP2FAAH |
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-4568960-A1 | BICYCLIC TETRAHYDROAZEPINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2025-06-18 | — | — | EP | disclosed |
| WO-2024033458-A1 | BICYCLIC TETRAHYDROAZEPINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2024-02-15 | — | — | WO | disclosed |