Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | SQLE | Q14534 | 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 | |
|---|---|---|---|---|
| SCHEMBL5043554 | 0.76 | ALOX15 (0.47) | ALOX15TSHRALDH1A1SRC | |
| SCHEMBL11448639 | 0.74 | TSHR (0.42) | ALOX15TSHRALDH1A1SQLE | |
| SCHEMBL9515041 | 0.74 | ALOX15 (0.48) | ALOX15TSHRALDH1A1SRCSQLE | |
| Beta-Citronellene SCHEMBL2456981 | 0.71 | ALOX15 (0.50) | ALOX15TSHRALDH1A1SRC | |
| Beta-Citronellene SCHEMBL21872 | 0.71 | ALOX15 (0.50) | ALOX15TSHRALDH1A1SRC | |
| Beta-Citronellene SCHEMBL7808244 | 0.71 | ALOX15 (0.50) | ALOX15TSHRALDH1A1SRC | |
| SCHEMBL7789930 | 0.70 | ALOX15 (0.48) | ALOX15TSHRALDH1A1SRC | |
| SCHEMBL14331466 | 0.70 | ALOX15 (0.48) | ALOX15TSHRALDH1A1SRC | |
| SCHEMBL14323435 | 0.70 | ALOX15 (0.48) | ALOX15TSHRALDH1A1SRC | |
| SCHEMBL11455401 | 0.69 | ALOX15 (0.47) | ALOX15TSHRALDH1A1 |
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-4226892-A | Flavoring with cycloaliphatic unsaturated ketones | FIRMENICH SA (CH) | 1980-10-07 | — | — | US | disclosed |
| US-4187863-A | Cycloaliphatic unsaturated ketones as odor and taste modifying agents in tobacco products | FIRMENICH SA (CH) | 1980-02-12 | — | — | US | disclosed |
| US-3975310-A | PERFUME | FIRMENICH S.A. (CH) | 1976-08-17 | — | — | US | disclosed |
| US-3931326-A | FLAVOR, TASTE, ODOR, PERFUMES | FIRMENICH SA (CH) | 1976-01-06 | — | — | US | disclosed |