⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL12609248 | 1.00 | — | — | |
| SCHEMBL6802898 | 0.85 | HCAR2 (0.47) | — | |
| SCHEMBL12651643 | 0.78 | — | — | |
| SCHEMBL28977419 | 0.76 | HCAR2 (0.56) | — | |
| SCHEMBL5222112 | 0.76 | NFE2L2 (0.68) | — | |
| SCHEMBL7070307 | 0.76 | HCAR2 (0.39) | — | |
| SCHEMBL7070305 | 0.76 | HCAR2 (0.39) | — | |
| SCHEMBL16277267 | 0.76 | NFE2L2 (0.68) | — | |
| SCHEMBL10981310 | 0.75 | KEAP1 (0.32) | — | |
| SCHEMBL5385169 | 0.74 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1000006-B1 | IMPROVED PROCESS OF PREPARATION OF LINEAR ALDEHYDES | DU PONT (US) | 2003-01-22 | — | — | EP | disclosed |
| US-6175043-B1 | SEPARATING THE HYDROFORMYLATION REACTION PRODUCTS IN THE POLAR PHASE SOLVENT FROM THE CATALYST IN THE NON-POLAR PHASE SOLVENT, BY USING AN ORGANIC PHOSPHITE LIGAND WITH ATTACHED C9 TO C40 ALIPHATIC GROUP RENDERING THE LIGAND LIPOPHILIC | E. I. DU PONT DE NEMOURS AND COMPANY | 2001-01-16 | — | — | US | disclosed |
| EP-1000006-A1 | IMPROVED PROCESS OF PREPARATION OF LINEAR ALDEHYDES | E.I. DU PONT DE NEMOURS & COMPANY INCORPORATED (US) | 2000-05-17 | — | — | EP | disclosed |
| WO-1999006345-A1 | IMPROVED PROCESS OF PREPARATION OF LINEAR ALDEHYDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1999-02-11 | — | — | WO | disclosed |