Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.49 |
| ▸ | FYN | P06241 | 10/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 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 | |
|---|---|---|---|---|
| SCHEMBL31375485 | 0.83 | RAB9A (0.39) | ABL1NPC1RAB9ASMN1; SMN2CYP11B1 | |
| SCHEMBL8239627 | 0.83 | RAB9A (0.49) | ABL1NPC1RAB9ASMN1; SMN2CYP11B1 | |
| SCHEMBL30767487 | 0.83 | CYP11B1 (0.37) | ABL1NPC1RAB9ASMN1; SMN2CYP11B1 | |
| SCHEMBL31664992 | 0.80 | KDM1A (0.46) | KDM1AFYNCHEK1CHEK2ABL1 | |
| SCHEMBL508027 | 0.77 | FYN (0.56) | KDM1AFYNABL1NPC1RAB9A | |
| SCHEMBL31375514 | 0.77 | KDM1A (0.45) | KDM1AABL1CYP11B1CYP11B2 | |
| SCHEMBL21816554 | 0.76 | MAPT (0.43) | KDM1AFYNNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL472558 | 0.75 | TSHR (0.43) | MKNK1MKNK2 | |
| SCHEMBL21034957 | 0.74 | KDM1A (0.47) | KDM1AFYNNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30767660 | 0.74 | KDM1A (0.47) | 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 |