Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL13497198 | 1.00 | TDP1 (0.36) | TDP1TSHRALDH1A1MAPK1 | |
| SCHEMBL14895459 | 0.88 | HSD17B10 (0.39) | TDP1TSHR | |
| SCHEMBL8524164 | 0.86 | TDP1 (0.33) | TDP1 | |
| SCHEMBL28699670 | 0.83 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL9562540 | 0.81 | TDP1 (0.33) | TDP1 | |
| SCHEMBL8424948 | 0.81 | TDP1 (0.33) | TDP1 | |
| SCHEMBL6245770 | 0.81 | LMNA (0.37) | ALDH1A1 | |
| SCHEMBL29144523 | 0.79 | MGAM (0.39) | TDP1TSHRALDH1A1 | |
| SCHEMBL16094208 | 0.79 | TDP1 (0.32) | TDP1 | |
| SCHEMBL12180771 | 0.79 | TSHR (0.33) | TSHRMAPK1 |
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-0080529-A1 | 2-Cyano-substituted 1,3-dioxane and dioxolane derivatives | THE DOW CHEMICAL COMPANY (US) | 1983-06-08 | — | — | EP | disclosed |
| US-4365073-A | Derivatives of cyano-substituted ketones and aldehydes | THE DOW CHEMICAL COMPANY (US) | 1982-12-21 | — | — | US | disclosed |