Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.33 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 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 SCHEMBL28125250 | 0.87 | ALDH1A1 (0.52) | TSHRMAPK1MEN1KMT2AALDH1A1 | |
| Ethylene Glycol SCHEMBL3420867 | 0.78 | TRIM24 (0.44) | TSHRKMT2AALDH1A1TRIM24TRIM33 | |
| Succinimide SCHEMBL28503670 | 0.77 | CRBN (0.52) | TSHRMAPK1MEN1KMT2AALDH1A1 | |
| Butoxyethanol SCHEMBL23121479 | 0.76 | TSHR (0.61) | TSHRMAPK1MEN1KMT2AALDH1A1 | |
| SCHEMBL22543431 | 0.75 | MGLL (0.45) | TSHRMAPK1MEN1KMT2AALDH1A1 | |
| Di(Hydroxyethyl)Ether SCHEMBL1462 | 0.74 | — | — | |
| Di(Hydroxyethyl)Ether SCHEMBL2410410 | 0.74 | TSHR (1.00) | TSHRMAPK1MEN1KMT2AALDH1A1 | |
| Ethylene Glycol SCHEMBL3420865 | 0.73 | TRIM24 (0.39) | TSHRALDH1A1TRIM24TRIM33 | |
| Di(Hydroxyethyl)Ether SCHEMBL7805707 | 0.72 | TSHR (0.77) | TSHRMAPK1MEN1KMT2AALDH1A1 | |
| Di(Hydroxyethyl)Ether SCHEMBL5213209 | 0.72 | — | — |
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-115215832-B | Preparation method of 1,4-cyclohexanedione mono ketal | 无锡科华生物科技有限公司 | 2023-06-23 | — | — | CN | disclosed |
| CN-115215832-A | Preparation method of 1,4-cyclohexanedione mono-ketal | 无锡科华生物科技有限公司 | 2022-10-21 | — | — | CN | disclosed |