⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27515686 | 0.74 | — | — | |
| SCHEMBL8651731 | 0.71 | — | — | |
| SCHEMBL27384963 | 0.69 | — | — | |
| SCHEMBL991546 | 0.69 | — | — | |
| SCHEMBL7750541 | 0.62 | — | — | |
| SCHEMBL8740862 | 0.60 | — | — | |
| SCHEMBL29749227 | 0.60 | — | — | |
| SCHEMBL6305412 | 0.59 | — | — | |
| SCHEMBL3145441 | 0.56 | — | — | |
| SCHEMBL11835122 | 0.49 | GPR35 (0.60) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-119504763-A | Nitrogen-enriched condensed ring energetic compound and preparation method thereof | 西南科技大学 | 2025-02-25 | — | — | CN | disclosed |
| CN-114133340-B | Oxalyl dihydrazide nitrate metal complex suitable for solid propellant and preparation method thereof | 湖北航天化学技术研究所 | 2024-03-15 | — | — | CN | disclosed |
| CN-114133340-A | Oxalyl dihydrazide nitrate metal complex suitable for solid propellant and preparation method thereof | 湖北航天化学技术研究所 | 2022-03-04 | — | — | CN | disclosed |