Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.44 |
| ▸ | ACACB | O00763 | 4/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 6/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19809307 | 0.91 | PTGS1 (0.57) | PTGS1SLC6A2SLC6A4KCNH2ACACB | |
| SCHEMBL2951490 | 0.91 | PTGS1 (0.57) | PTGS1SLC6A2SLC6A4KCNH2ACACB | |
| SCHEMBL5543740 | 0.83 | PTGS1 (0.45) | PTGS1SLC6A2SLC6A4KCNH2CHRM1 | |
| SCHEMBL5543733 | 0.83 | PTGS1 (0.45) | PTGS1SLC6A2SLC6A4KCNH2CHRM1 | |
| SCHEMBL19929307 | 0.82 | PTGS1 (0.58) | PTGS1SLC6A2SLC6A4KCNH2ACACB | |
| SCHEMBL12902233 | 0.79 | KCNH2 (0.40) | PTGS1SLC6A2SLC6A4KCNH2CHRM1 | |
| SCHEMBL22527429 | 0.77 | KCNH2 (0.54) | PTGS1SLC6A2SLC6A4KCNH2ACACB | |
| SCHEMBL2314441 | 0.77 | KCNH2 (0.54) | PTGS1SLC6A2SLC6A4KCNH2ACACB | |
| SCHEMBL2311795 | 0.77 | KCNH2 (0.54) | PTGS1SLC6A2SLC6A4KCNH2ACACB | |
| SCHEMBL1228757 | 0.77 | CHRM1 (0.44) | PTGS1SLC6A2SLC6A4KCNH2CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113874341-B | Process for preparing derivatives of 1, 1-dialkylethane-1, 2-diols useful as intermediates | 科学与工业研究委员会 | 2024-05-31 | — | — | CN | disclosed |
| CN-113874341-A | Process for preparing derivatives of 1, 1-dialkylethane-1, 2-diols as useful intermediates | 科学与工业研究委员会 | 2021-12-31 | — | — | CN | disclosed |
| WO-2020202205-A1 | PROCESS FOR THE PREPARATION OF DERIVATIVES OF 1,1-DIALKYLETHANE-1,2-DIOLS AS USEFUL INTERMEDIATES | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2020-10-08 | — | — | WO | disclosed |