⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31474435 | 0.93 | — | — | |
| SCHEMBL130281 | 0.91 | — | — | |
| SCHEMBL10966659 | 0.91 | — | — | |
| SCHEMBL11310504 | 0.91 | — | — | |
| SCHEMBL1037598 | 0.91 | — | — | |
| SCHEMBL21951632 | 0.91 | — | — | |
| SCHEMBL25308070 | 0.83 | — | — | |
| SCHEMBL14937262 | 0.83 | — | — | |
| SCHEMBL4290880 | 0.83 | — | — | |
| SCHEMBL16106974 | 0.83 | — | — |
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-119824540-A | Compound yttrium lead rubidium borate and yttrium lead rubidium borate nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2025-04-15 | — | — | CN | disclosed |