Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL6444644 | 0.90 | — | — | |
| SCHEMBL28153885 | 0.78 | TSHR (0.35) | — | |
| SCHEMBL11286216 | 0.78 | ATM (0.32) | — | |
| SCHEMBL9615160 | 0.73 | TSHR (0.30) | ALDH1A1 | |
| SCHEMBL21996328 | 0.73 | CHRM2 (0.38) | ALDH1A1 | |
| SCHEMBL11632239 | 0.72 | BCHE (0.46) | — | |
| SCHEMBL20578240 | 0.72 | ALDH1A1 (0.43) | ALDH1A1 | |
| SCHEMBL3886205 | 0.71 | — | — | |
| SCHEMBL486112 | 0.71 | — | — | |
| SCHEMBL3874885 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0046488-A3 | SUBSTITUTED 2,5,7-TRIOXA-BICYCLO(2.2.2)OCTAN-6-ONES, 3,6,8-TRIOXA-BICYCLO(3.2.1)OCTAN-4-ONES AND 1,3-DIOXANE-CARBOXYLIC ACID AND 1,3-DIOXOLANE-2-CARBOXYLIC ACID COMPOUNDS, AND THEIR PREPARATION | HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) | 1982-06-02 | — | — | EP | disclosed |
| EP-0046488-A2 | Substituted 2,5,7-trioxa-bicyclo(2.2.2)octan-6-ones, 3,6,8-trioxa-bicyclo(3.2.1)octan-4-ones and 1,3-dioxane-carboxylic acid and 1,3-dioxolane-2-carboxylic acid compounds, and their preparation | HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) | 1982-03-03 | — | — | EP | disclosed |