⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28204130 | 0.87 | — | — | |
| SCHEMBL6009857 | 0.87 | — | — | |
| SCHEMBL27570566 | 0.87 | — | — | |
| SCHEMBL10779165 | 0.87 | — | — | |
| SCHEMBL8799207 | 0.75 | — | — | |
| SCHEMBL1940159 | 0.75 | — | — | |
| Water SCHEMBL28189259 | 0.75 | — | — | |
| SCHEMBL7788374 | 0.75 | — | — | |
| SCHEMBL3287243 | 0.75 | — | — | |
| Ammonia Solution, Strong SCHEMBL28115205 | 0.75 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090053134-A1 | PROCESS, COMPOSITION OF MATTER, AND APPARATUS FOR GENERATING HYDROGEN FROM A CHEMICAL HYDRIDE | TRULITE, INC. (US) | 2009-02-26 | — | — | US | claimed |