Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
| ▸ | TERT | O14746 | 1/20 | 0.35 |
| ▸ | GLS | O94925 | 2/20 | 0.35 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28990302 | 1.00 | AHR (0.38) | AHRHRH4HRH3CCNE1CDK2 | |
| SCHEMBL30374043 | 0.87 | AHR (0.38) | AHRMAOBTERTAADATNOTUM | |
| SCHEMBL28990299 | 0.87 | AHR (0.38) | AHRMAOBTERTAADATNOTUM | |
| SCHEMBL28990303 | 0.87 | AHR (0.38) | AHRMAOBTERTAADATNOTUM | |
| SCHEMBL30373799 | 0.81 | FABP6 (0.37) | HRH3MAOBNOTUM | |
| SCHEMBL28990343 | 0.81 | FABP6 (0.37) | HRH3MAOBNOTUM | |
| SCHEMBL28990345 | 0.81 | FABP6 (0.37) | HRH3MAOBNOTUM | |
| SCHEMBL30374092 | 0.80 | GAA (0.42) | MAOBAADATSRD5A1 | |
| SCHEMBL28990325 | 0.80 | SIRT1 (0.40) | AHRCCNE1CDK2GLSMETAP1 | |
| SCHEMBL28990329 | 0.80 | SIRT1 (0.40) | AHRCCNE1CDK2GLSMETAP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115991695-B | Method for preparing 3-fluorochromanone by metal-free catalytic hydrogenation | 中国科学院化学研究所 | 2024-06-21 | — | — | CN | disclosed |
| CN-115991695-A | Method for preparing 3-fluorochromanone by metal-free catalytic hydrogenation | 中国科学院化学研究所 | 2023-04-21 | — | — | CN | disclosed |