⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12055953 | 0.84 | — | — | |
| Hydrazine SCHEMBL11413620 | 0.76 | — | — | |
| Hydrazine SCHEMBL11419921 | 0.72 | — | — | |
| Hydrazine SCHEMBL11416430 | 0.68 | — | — | |
| SCHEMBL3784336 | 0.67 | — | — | |
| SCHEMBL3101148 | 0.63 | — | — | |
| SCHEMBL3114131 | 0.63 | — | — | |
| SCHEMBL2464581 | 0.62 | — | — | |
| SCHEMBL13078051 | 0.57 | — | — | |
| SCHEMBL16976248 | 0.57 | — | — |
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-4201553-A | AMMONIA OR AMINE FUEL, HYDROGEN CARRIER | OSBORG HANS | 1980-05-06 | — | — | US | disclosed |
| US-4197081-A | AMINE-BORANE HYDROGEN CARRIER | OSBORG HANS | 1980-04-08 | — | — | US | disclosed |