⚠ 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 | |
|---|---|---|---|---|
| Nitrous Acid SCHEMBL42673 | 1.00 | — | — | |
| Nitrous Acid SCHEMBL27233017 | 0.94 | — | — | |
| Nitrous Acid SCHEMBL3804687 | 0.94 | — | — | |
| Nitrous Acid SCHEMBL27206419 | 0.94 | — | — | |
| Nitrous Acid SCHEMBL2512848 | 0.94 | — | — | |
| Nitrous Acid SCHEMBL23456534 | 0.94 | — | — | |
| Nitrous Acid SCHEMBL1659700 | 0.94 | — | — | |
| Nitrous Acid SCHEMBL4562014 | 0.94 | — | — | |
| Nitrous Acid SCHEMBL22406194 | 0.94 | — | — | |
| Nitrous Acid SCHEMBL4551716 | 0.94 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109859959-A | A kind of lithium ion super capacitor cathode pre-embedding lithium method | 中国科学院大连化学物理研究所 | 2019-06-07 | — | — | CN | disclosed |