⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31612599 | 1.00 | — | — | |
| SCHEMBL31612600 | 1.00 | — | — | |
| SCHEMBL19816266 | 0.78 | — | — | |
| SCHEMBL6055176 | 0.74 | — | — | |
| SCHEMBL15056481 | 0.70 | — | — | |
| SCHEMBL29002446 | 0.68 | — | — | |
| SCHEMBL9503371 | 0.65 | — | — | |
| SCHEMBL10730244 | 0.64 | — | — | |
| SCHEMBL4838153 | 0.63 | TSHR (0.30) | — | |
| SCHEMBL12497498 | 0.62 | — | — |
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-120118870-A | Genetically engineered bacterium, method for synthesizing (R) -2-bromo-2-chlorophenyl ethanol by using genetically engineered bacterium and related enzyme | 浙江海正药业股份有限公司 | 2025-06-10 | — | — | CN | disclosed |