⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10444714 | 0.78 | — | — | |
| SCHEMBL28291404 | 0.78 | — | — | |
| SCHEMBL5351407 | 0.67 | — | — | |
| SCHEMBL10523821 | 0.67 | — | — | |
| Arsenic SCHEMBL9742654 | 0.67 | — | — | |
| SCHEMBL15443500 | 0.63 | — | — | |
| SCHEMBL11520905 | 0.63 | — | — | |
| SCHEMBL814883 | 0.63 | — | — | |
| SCHEMBL5942929 | 0.63 | — | — | |
| SCHEMBL10776780 | 0.63 | — | — |
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-5728913-A | BASE METAL ALLOY CATALYST | ADVANCED POWER SYSTEMS INTERNATIONAL, INC. | 1998-03-17 | — | — | US | disclosed |
| US-5625118-A | Method of improving the performance of hydrocarbon fuels | ADVANCED POWER SYSTEMS INTERNATIONAL INC. | 1997-04-29 | — | — | US | disclosed |