Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30564360 | 0.86 | MAPT (0.39) | ALDH1A1MAPT | |
| SCHEMBL30564392 | 0.73 | KMT2A (0.31) | — | |
| SCHEMBL25532412 | 0.71 | ELANE (0.35) | ALDH1A1MAPT | |
| SCHEMBL30564398 | 0.71 | ELANE (0.35) | ALDH1A1MAPT | |
| SCHEMBL25532416 | 0.69 | SIRT2 (0.30) | — | |
| SCHEMBL30857996 | 0.68 | CYP1A1 (0.53) | ALDH1A1MAPT | |
| SCHEMBL30564408 | 0.67 | — | — | |
| SCHEMBL30564390 | 0.65 | — | — | |
| SCHEMBL30564381 | 0.65 | ELANE (0.34) | — | |
| SCHEMBL25532421 | 0.64 | PIK3CA (0.44) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116715658-A | Benzocyclic ketone derivative regulator, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-09-08 | — | — | CN | disclosed |