Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | FAAH | O00519 | 2/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | EP300 | Q09472 | 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 | |
|---|---|---|---|---|
| Butanal SCHEMBL7636137 | 0.89 | ALDH1A1 (0.55) | ALDH1A1TSHRFAAHTRPV1 | |
| Butanal SCHEMBL7636134 | 0.89 | ALDH1A1 (0.55) | ALDH1A1TSHRFAAHTRPV1 | |
| Butanal SCHEMBL17181547 | 0.87 | ALDH1A1 (0.52) | ALDH1A1TSHRFAAHTRPV1 | |
| Butanal SCHEMBL1117153 | 0.82 | ALDH1A1 (0.63) | ALDH1A1TSHRFAAHTRPV1SMN1; SMN2 | |
| SCHEMBL366897 | 0.82 | — | — | |
| SCHEMBL6554564 | 0.82 | — | — | |
| SCHEMBL366896 | 0.82 | — | — | |
| Butanal SCHEMBL6441925 | 0.82 | ALDH1A1 (0.63) | ALDH1A1TSHRFAAHTRPV1SMN1; SMN2 | |
| Butanal SCHEMBL8140256 | 0.80 | ALDH1A1 (0.51) | ALDH1A1TSHRSMN1; SMN2LMNA | |
| Butanal SCHEMBL8140258 | 0.80 | ALDH1A1 (0.51) | ALDH1A1TSHRSMN1; SMN2LMNA |
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-3880640-A1 | SELF-CONDENSATION OF ALDEHYDES | Eastman Chemical Company (US) | 2021-09-22 | — | — | EP | disclosed |
| WO-2020101902-A1 | SELF-CONDENSATION OF ALDEHYDES | EASTMAN CHEMICAL COMPANY (US) | 2020-05-22 | — | — | WO | disclosed |