⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21697902 | 0.61 | — | — | |
| SCHEMBL630410 | 0.60 | — | — | |
| SCHEMBL6219789 | 0.55 | — | — | |
| SCHEMBL22339729 | 0.53 | — | — | |
| SCHEMBL11602548 | 0.42 | NOTUM (0.42) | — | |
| SCHEMBL6261116 | 0.41 | NOTUM (0.40) | — | |
| SCHEMBL74197 | 0.39 | — | — | |
| SCHEMBL29131749 | 0.39 | TSHR (0.38) | — | |
| SCHEMBL6754916 | 0.38 | POLB (0.41) | — | |
| SCHEMBL11632516 | 0.38 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6878663-B2 | Method for producing palladium complex compound | CENTRAL GLASS COMPANY, LIMITED (JP) | 2005-04-12 | — | — | US | disclosed |
| EP-1008601-B1 | Method for producing palladium complex compound | CENTRAL GLASS CO LTD (JP) | 2005-03-09 | — | — | EP | disclosed |
| US-6706905-B1 | REACTING AROMATIC COMPOUND, PALLADIUM(II) COMPOUND, AND PHOSPHINE DERIVATIVE; COMPLEXING WITH BENZOIC ACID DERIVATIVE; METALLIZATION | CENTRAL GLASS COMPANY, LIMITED (JP) | 2004-03-16 | — | — | US | disclosed |
| US-20020111482-A1 | Method for producing palladium complex compound | CENTRAL GLASS COMPANY, LIMITED | 2002-08-15 | — | — | US | disclosed |
| EP-1008601-A2 | Method for producing palladium complex compound | Central Glass Company, Limited (JP) | 2000-06-14 | — | — | EP | disclosed |