⚠ 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 | |
|---|---|---|---|---|
| Phosphoric Acid SCHEMBL29016943 | 0.82 | CDC25A (0.34) | — | |
| SCHEMBL25624606 | 0.80 | KDM4E (0.33) | — | |
| Cyclopropane SCHEMBL8849477 | 0.80 | KDM4E (0.33) | — | |
| SCHEMBL16566642 | 0.80 | KDM4E (0.33) | — | |
| SCHEMBL2857671 | 0.80 | — | — | |
| SCHEMBL12757222 | 0.80 | KDM4E (0.33) | — | |
| SCHEMBL19307668 | 0.80 | KDM4E (0.33) | — | |
| Hydrochloric Acid SCHEMBL23797807 | 0.77 | KDM4E (0.32) | — | |
| Water SCHEMBL16566713 | 0.77 | KDM4E (0.32) | — | |
| SCHEMBL10387924 | 0.77 | — | — |
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-116261763-A | Electrolyte additive for lithium ion battery | 诺姆斯科技股份有限公司 | 2023-06-13 | — | — | CN | disclosed |