⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5596861 | 0.79 | POLB (0.37) | — | |
| SCHEMBL4629783 | 0.79 | MPO (0.39) | — | |
| SCHEMBL301548 | 0.79 | LIPG (0.40) | — | |
| SCHEMBL5729888 | 0.78 | LIPG (0.47) | — | |
| SCHEMBL6279009 | 0.76 | LIPG (0.50) | — | |
| SCHEMBL339550 | 0.76 | LIPG (0.50) | — | |
| SCHEMBL29210030 | 0.76 | LIPG (0.50) | — | |
| Hydrochloric Acid SCHEMBL29193922 | 0.76 | LIPG (0.46) | — | |
| SCHEMBL2922724 | 0.76 | LIPG (0.50) | — | |
| SCHEMBL6285351 | 0.76 | LIPG (0.50) | — |
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-1841534-A2 | PREPARATION OF TRIDENTATE PHOSPHINES, METHOD OF FORMING ALDEHYDE HYDROGENATION CATALYSTS USING THEM AND PROCESS FOR ALDEHYDE HYDROGENATION | Dow Gloval Technologies Inc. (US) | 2007-10-10 | — | — | EP | disclosed |
| US-7217848-B2 | Hydrogenation of aldehydes to alcohols using novel homogeneous catalysts, catalysts are generated in situ under hydrogen and carbon monoxide gases in a suitable solvent, by mixing a rhodium catalyst precursor, such as Rh(CO)2 acetoacetonate and a phosphine ligand | DOW GLOBAL TECHNOLOGIES INC. (US) | 2007-05-15 | — | — | US | disclosed |
| WO-2006058184-A2 | PREPARATION OF TRIDENTATE PHOSPHINES, METHOD OF FORMING ALDEHYDE HYDROGENATION CATALYSTS USING THEM AND PROCESS FOR ALDEHYDE HYDROGENATION | DOW GLOBAL TECHNOLOGIES INC. (US) | 2006-06-01 | — | — | WO | disclosed |
| US-20060116536-A1 | Novel tridentate phosphines and method of forming aldehyde hydrogenation catalysts | DOW GLOBAL TECHNOLOGIES INC. | 2006-06-01 | — | — | US | disclosed |