Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9256118 | 0.86 | ALDH1A1 (0.41) | MAPTALOX15MEN1CYP3A4KMT2A | |
| SCHEMBL13431064 | 0.82 | TSHR (0.32) | MAPT | |
| SCHEMBL9390107 | 0.82 | MAPT (0.38) | MAPTALOX15MEN1CYP3A4KMT2A | |
| SCHEMBL10861366 | 0.81 | TSHR (0.40) | MAPTALOX15MEN1CYP3A4KMT2A | |
| SCHEMBL13384231 | 0.80 | TSHR (0.38) | — | |
| SCHEMBL21625685 | 0.79 | TSHR (0.41) | — | |
| SCHEMBL1537973 | 0.79 | — | — | |
| SCHEMBL14338184 | 0.79 | ALOX15 (0.31) | ALOX15MEN1CYP3A4KMT2A | |
| SCHEMBL9263091 | 0.77 | MEN1 (0.53) | MAPTALOX15MEN1CYP3A4KMT2A | |
| SCHEMBL10609365 | 0.77 | MAPT (0.31) | MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0003361-B1 | 3,5,5-TRIMETHYLHEXANE-1-OLS AND THEIR ESTERS, THEIR SYNTHESES AND THEIR APPLICATION AS ODORANTS | BASF Aktiengesellschaft (DE) | 1982-06-16 | — | — | EP | disclosed |
| EP-0003361-A1 | 3,5,5-Trimethylhexane-1-ols and their esters, their syntheses and their application as odorants | BASF Aktiengesellschaft (DE) | 1979-08-08 | — | — | EP | disclosed |