Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.31 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11074002 | 1.00 | ALDH1A1 (0.32) | ALDH1A1TRPA1TRPM8 | |
| SCHEMBL31159674 | 0.91 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL11067015 | 0.87 | L3MBTL1 (0.35) | TRPA1TRPM8 | |
| SCHEMBL11067012 | 0.87 | L3MBTL1 (0.35) | TRPA1TRPM8 | |
| SCHEMBL11067021 | 0.87 | L3MBTL1 (0.35) | TRPA1TRPM8 | |
| SCHEMBL31387577 | 0.86 | — | — | |
| SCHEMBL31159672 | 0.86 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL3941527 | 0.82 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL8523864 | 0.81 | — | — | |
| SCHEMBL5779865 | 0.79 | ALDH1A1 (0.47) | ALDH1A1TRPA1TRPM8 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4434073-A | Perhydrophenanthrene derivatives, their preparation, and their use in liquid-crystalline dielectrics and electro-optical display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1984-02-28 | — | — | US | disclosed |