Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.52 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| Cyclohexanone SCHEMBL19973161 | 0.98 | ALDH1A1 (0.55) | ALDH1A1TRIM24TRIM33TDP1FFAR3 | |
| Cycloheptanone SCHEMBL28260320 | 0.98 | ALDH1A1 (0.55) | ALDH1A1TRIM24TRIM33TDP1FFAR3 | |
| Cyclohexanone SCHEMBL240660 | 0.98 | ALDH1A1 (0.55) | ALDH1A1TRIM24TRIM33TDP1FFAR3 | |
| Cyclohexanone SCHEMBL28514640 | 0.96 | ALDH1A1 (0.48) | ALDH1A1TRIM24TRIM33TDP1FFAR3 | |
| Cyclopentanone SCHEMBL2749777 | 0.95 | ALDH1A1 (0.53) | ALDH1A1TRIM24TRIM33TDP1FFAR3 | |
| Cyclohexanone SCHEMBL27573382 | 0.90 | ALDH1A1 (0.42) | ALDH1A1TRIM24TRIM33TDP1 | |
| Cyclohexanone SCHEMBL1071504 | 0.87 | TRIM24 (0.69) | ALDH1A1TRIM24TRIM33 | |
| Cyclohexanone SCHEMBL11783871 | 0.85 | ALDH1A1 (0.58) | ALDH1A1TRIM24TRIM33TDP1FFAR3 | |
| Cyclohexanone SCHEMBL977979 | 0.85 | ALDH1A1 (0.58) | ALDH1A1TRIM24TRIM33TDP1FFAR3 | |
| Cyclopentanone SCHEMBL3625536 | 0.85 | ALDH1A1 (0.58) | ALDH1A1TRIM24TRIM33TDP1FFAR3 |
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-105970298-A | Method for preparing mesoscopic scale line-shaped organic crystal | 上海理工大学 | 2016-09-28 | — | — | CN | claimed |
| CN-105970298-A | Method for preparing mesoscopic scale line-shaped organic crystal | 上海理工大学 | 2016-09-28 | — | — | CN | disclosed |