Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL1326257 | 0.91 | KCNN4 (0.36) | KCNN4TSHRALDH1A1 | |
| SCHEMBL19002936 | 0.88 | NPC1 (0.32) | ALDH1A1 | |
| SCHEMBL411476 | 0.81 | ALDH1A1 (0.38) | KCNN4TSHRALDH1A1 | |
| SCHEMBL1368134 | 0.79 | KCNN4 (0.41) | KCNN4TSHRALDH1A1 | |
| SCHEMBL2571569 | 0.79 | ALDH1A1 (0.37) | KCNN4TSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL465147 | 0.79 | ALDH1A1 (0.37) | KCNN4TSHRALDH1A1 | |
| Water SCHEMBL10839715 | 0.79 | ALDH1A1 (0.37) | KCNN4TSHRALDH1A1 | |
| Bromide SCHEMBL659623 | 0.79 | ALDH1A1 (0.37) | KCNN4TSHRALDH1A1 | |
| SCHEMBL21530763 | 0.79 | KCNN4 (0.31) | KCNN4TSHRALDH1A1 | |
| Iodide SCHEMBL3443160 | 0.79 | ALDH1A1 (0.37) | KCNN4TSHRALDH1A1 |
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-3507269-B1 | STABLE HYDROFORMYLATION CATALYST FOR PREPARATION OF HIGH N/ISO RATIO ALDEHYDE PRODUCT | EASTMAN CHEM CO (US) | 2020-09-23 | — | — | EP | disclosed |
| US-9687837-B1 | Stable hydroformylation catalyst for preparation of high N/Iso ratio aldehyde product | EASTMAN CHEMICAL COMPANY (US) | 2017-06-27 | — | — | US | disclosed |