⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11618219 | 1.00 | — | — | |
| SCHEMBL15663 | 0.97 | — | — | |
| Hydrogen Sulfide SCHEMBL7638603 | 0.97 | — | — | |
| SCHEMBL23199234 | 0.94 | — | — | |
| SCHEMBL8773572 | 0.94 | — | — | |
| SCHEMBL29878809 | 0.94 | — | — | |
| SCHEMBL8744575 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL429473 | 0.94 | — | — | |
| Methane SCHEMBL4558430 | 0.94 | — | — | |
| SCHEMBL539983 | 0.94 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7081544-B2 | aromatic fused phosphepine ligands, e.g., 4-Phenyl-4,5-dihydro-3H-dinaphtho[2,1-c; 1',2'-e]phosphepine and their preparation from 2,2'-dimethylbiphenyls or binaphthyls and aminophosphorus dichlorides or aryl or alkyl phosphorus dichlorides; hydrogenation catalysts with metal compounds | DEGUSSA AG (DE) | 2006-07-25 | — | — | US | disclosed |
| US-20040249184-A1 | Novel chiral ligands, transition metal complexes thereof, and the catalytic use of the same | EVONIK DEGUSSA GMBH (DE) | 2004-12-09 | — | — | US | disclosed |