⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3114131 | 0.94 | — | — | |
| SCHEMBL3117591 | 0.94 | — | — | |
| SCHEMBL3101148 | 0.94 | — | — | |
| SCHEMBL3106452 | 0.94 | — | — | |
| SCHEMBL3112741 | 0.94 | — | — | |
| SCHEMBL23766377 | 0.75 | — | — | |
| SCHEMBL2464581 | 0.72 | — | — | |
| SCHEMBL24997229 | 0.71 | — | — | |
| SCHEMBL13434830 | 0.69 | — | — | |
| Hydrazine SCHEMBL11422503 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8673510-B2 | Systems and methods for maintaining hydrogen-selective membranes during periods of inactivity | DCNS SA (FR) | 2014-03-18 | — | — | US | disclosed |
| EP-2487133-A1 | A hydrogen storage material and a process for release of hydrogen | National University of Singapore (SG) | 2012-08-15 | — | — | EP | disclosed |
| US-20100329974-A1 | HYDROGEN STORAGE MATERIAL AND A PROCESS FOR RELEASE OF HYDROGEN | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2010-12-30 | — | — | US | disclosed |