Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.33 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | APP | P05067 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | SNCA | P37840 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | RBP4 | P02753 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10941814 | 0.70 | MAOA (0.34) | — | |
| SCHEMBL9050071 | 0.69 | ALDH1A1 (0.35) | CYP1A2ALDH1A1LMNAPTGS1DRD3 | |
| SCHEMBL11475065 | 0.67 | ALDH1A1 (0.38) | CYP1A2HAO1ALDH1A1LMNAPTGS1 | |
| SCHEMBL21755930 | 0.67 | ALDH1A1 (0.34) | CYP1A2HAO1ALDH1A1LMNAPTGS1 | |
| SCHEMBL21755917 | 0.67 | CYP1A2 (0.34) | CYP1A2HAO1ALDH1A1LMNAPTGS1 | |
| SCHEMBL1105235 | 0.66 | MAPT (0.41) | CYP1A2ALDH1A1LMNACYP3A4MAPT | |
| SCHEMBL11455628 | 0.65 | CYP1A2 (0.36) | CYP1A2HAO1ALDH1A1LMNAPTGS1 | |
| SCHEMBL11447488 | 0.65 | CYP1A2 (0.43) | CYP1A2HAO1ALDH1A1LMNAPTGS1 | |
| SCHEMBL4105308 | 0.64 | CYP1A2 (0.53) | CYP1A2HAO1ALDH1A1LMNAPTGS1 | |
| SCHEMBL23605753 | 0.64 | ALOX15 (0.40) | CYP1A2HAO1ALDH1A1LMNAPTGS1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4543431-A | Process for the preparation of polyunsaturated cycloaliphatic ketones | FIRMENICH SA (CH) | 1985-09-24 | — | — | US | disclosed |
| EP-0070995-B1 | PROCESS FOR THE PREPARATION OF CYCLOALIPHATIC UNSATURATED KETONES | FIRMENICH SA (CH) | 1984-11-21 | — | — | EP | disclosed |
| US-4479011-A | Process for the preparation of polyunsaturated cycloaliphatic ketones | FIRMENICH SA (CH) | 1984-10-23 | — | — | US | disclosed |
| EP-0070995-A1 | Process for the preparation of cycloaliphatic unsaturated ketones | FIRMENICH SA (CH) | 1983-02-09 | — | — | EP | disclosed |