Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HAO1 | Q9UJM8 | 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 | |
|---|---|---|---|---|
| SCHEMBL10835074 | 0.82 | — | — | |
| SCHEMBL10834959 | 0.78 | — | — | |
| SCHEMBL10834680 | 0.72 | — | — | |
| SCHEMBL4843569 | 0.71 | CYP1A2 (0.37) | CYP1A2HAO1 | |
| SCHEMBL10833557 | 0.67 | — | — | |
| SCHEMBL10362288 | 0.67 | — | — | |
| SCHEMBL15057839 | 0.62 | — | — | |
| SCHEMBL4105308 | 0.61 | CYP1A2 (0.53) | CYP1A2HAO1 | |
| SCHEMBL13479221 | 0.60 | — | — | |
| SCHEMBL18927526 | 0.59 | CHRNB2 (0.55) | — |
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-4607109-A | Nitrogen containing compounds, their preparation and use of same for the preparation of decalin keton derivatives | FIRMENICH SA (CH) | 1986-08-19 | — | — | US | disclosed |