Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28340607 | 0.85 | TRPA1 (0.42) | TRPA1ALDH1A1LMNATDP1TSHR | |
| SCHEMBL4892118 | 0.82 | TSHR (0.36) | LMNATSHR | |
| SCHEMBL4610776 | 0.73 | TRPA1 (0.44) | TRPA1ALDH1A1LMNATDP1TSHR | |
| SCHEMBL4283257 | 0.72 | LMNA (0.48) | LMNATDP1TSHR | |
| SCHEMBL27414879 | 0.72 | — | — | |
| SCHEMBL10786182 | 0.72 | TRPA1 (0.47) | TRPA1ALDH1A1LMNATDP1TSHR | |
| SCHEMBL246160 | 0.71 | ALDH1A1 (0.52) | TRPA1ALDH1A1LMNATDP1TSHR | |
| SCHEMBL602930 | 0.71 | LMNA (0.65) | TRPA1ALDH1A1LMNATSHR | |
| SCHEMBL10263274 | 0.70 | TRPA1 (0.45) | TRPA1ALDH1A1LMNATDP1TSHR | |
| SCHEMBL135878 | 0.69 | — | — |
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-2970571-A1 | POLYESTER POLYOLS IMPARTING IMPROVED FLAMMABILITY PROPERTIES | Stepan Company (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014150207-A1 | POLYESTER POLYOLS IMPARTING IMPROVED FLAMMABILITY PROPERTIES | STEPAN COMPANY (US) | 2014-09-25 | — | — | WO | disclosed |