⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5859583 | 0.78 | — | — | |
| SCHEMBL409826 | 0.77 | KMT2A (0.31) | — | |
| Trimethylammonium SCHEMBL27547422 | 0.76 | — | — | |
| SCHEMBL12802885 | 0.75 | — | — | |
| SCHEMBL17731296 | 0.75 | GAA (0.46) | — | |
| SCHEMBL11377580 | 0.75 | MGAM (0.46) | — | |
| SCHEMBL411165 | 0.75 | TSHR (0.32) | — | |
| SCHEMBL14406272 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL23009497 | 0.73 | — | — | |
| SCHEMBL14666072 | 0.73 | — | — |
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-7595414-B2 | complex capable of being used for chemical vapor deposition of thin metal , or metal oxide films | UBE INDUSTRIES, LTD. (JP) | 2009-09-29 | — | — | US | disclosed |
| US-20080254216-A1 | Metal Complex Compound Comprising B-Diketonato Ligand | UBE INDUSTRIES, LTD. (JP) | 2008-10-16 | — | — | US | disclosed |