Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.47 |
| ▸ | FYN | P06241 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | GCK | P35557 | 1/20 | 0.40 |
| ▸ | GCKR | Q14397 | 1/20 | 0.40 |
| ▸ | BRS3 | P32247 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2269528 | 0.87 | KIF11 (0.51) | KDM1AFYNKIF11GCKGCKR | |
| SCHEMBL31375486 | 0.84 | RAB9A (0.40) | KDM1ANPC1RAB9ASMN1; SMN2KIF11 | |
| SCHEMBL30767444 | 0.84 | KIF11 (0.40) | KDM1ANPC1RAB9ASMN1; SMN2KIF11 | |
| SCHEMBL30633001 | 0.81 | PPARA (0.50) | KDM1AFYNNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1549725 | 0.81 | PPARA (0.50) | KDM1AFYNNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL31375576 | 0.80 | KDM1A (0.44) | KDM1AKIF11GCKGCKRBRS3 | |
| SCHEMBL1742369 | 0.77 | EPHX2 (0.44) | KIF11PPARA | |
| SCHEMBL21034957 | 0.75 | KDM1A (0.47) | KDM1AFYNNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17954213 | 0.75 | SMN1; SMN2 (0.66) | KDM1AFYNNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL508027 | 0.75 | FYN (0.56) | KDM1AFYNNPC1RAB9ASMN1; SMN2 |
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 |