Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11061166 | 0.83 | CYP1A2 (0.38) | CYP1A2HIF1AALDH1A1 | |
| SCHEMBL11058660 | 0.77 | DNTT (0.35) | CYP1A2HIF1AALDH1A1 | |
| SCHEMBL11064909 | 0.73 | CYP1A2 (0.38) | CYP1A2HIF1AALDH1A1 | |
| SCHEMBL11065655 | 0.70 | CYP1A2 (0.38) | CYP1A2HIF1AALDH1A1 | |
| SCHEMBL11059307 | 0.69 | CYP1A2 (0.40) | CYP1A2HIF1AALDH1A1 | |
| SCHEMBL11059939 | 0.69 | CYP1A2 (0.41) | CYP1A2HIF1AALDH1A1 | |
| SCHEMBL11065679 | 0.67 | CYP1A2 (0.38) | CYP1A2HIF1AALDH1A1 | |
| SCHEMBL11064883 | 0.67 | CYP1A2 (0.38) | CYP1A2HIF1AALDH1A1 | |
| SCHEMBL11061977 | 0.65 | DNTT (0.35) | CYP1A2HIF1A | |
| SCHEMBL11056056 | 0.63 | ALDH1A1 (0.47) | CYP1A2HIF1AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4432378-A | ORGANOLEPTIC; TOBACCO; FOODS; DETERGENTS; COSMETICS | FRITZSCHE, DODGE & OLCOTT, INC. (US) | 1984-02-21 | — | — | US | disclosed |
| US-4326996-A | FOR PERFUMES | FRITZSCHE DODGE & OLCOTT INC. (US) | 1982-04-27 | — | — | US | disclosed |
| US-4281204-A | ALKYLATION, DECARBOXYLATION TO CYCLIZE | FRITZSCHE DODGE & OLCOTT INC. (US) | 1981-07-28 | — | — | US | disclosed |