⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10985271 | 1.00 | — | — | |
| SCHEMBL10985269 | 1.00 | — | — | |
| SCHEMBL19451153 | 0.80 | — | — | |
| SCHEMBL10608752 | 0.77 | — | — | |
| SCHEMBL9242541 | 0.74 | — | — | |
| SCHEMBL6910303 | 0.74 | — | — | |
| SCHEMBL17581107 | 0.71 | — | — | |
| SCHEMBL282506 | 0.71 | — | — | |
| SCHEMBL2379897 | 0.71 | — | — | |
| SCHEMBL9921206 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4513157-A | USING CATALYST COMPRISING TRANSITION METAL COMPOUND AND ORGANOALUMINUM COMPOUND | CHEMISCHE WERKE HUELS, AG (DE) | 1985-04-23 | — | — | US | claimed |
| US-4434310-A | METAL AMIDE CATALYST | CHEMISCHE WERKE HUELS AKTIENGESELLSCHAFT (DE) | 1984-02-28 | — | — | US | claimed |
| US-4513157-A | USING CATALYST COMPRISING TRANSITION METAL COMPOUND AND ORGANOALUMINUM COMPOUND | CHEMISCHE WERKE HUELS, AG (DE) | 1985-04-23 | — | — | US | disclosed |
| US-4434310-A | METAL AMIDE CATALYST | CHEMISCHE WERKE HUELS AKTIENGESELLSCHAFT (DE) | 1984-02-28 | — | — | US | disclosed |