⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8715768 | 0.80 | — | — | |
| SCHEMBL2128606 | 0.70 | — | — | |
| Tribromoacetic Acid SCHEMBL210187 | 0.70 | — | — | |
| Tribromoacetic Acid SCHEMBL1331874 | 0.70 | — | — | |
| SCHEMBL1292273 | 0.69 | — | — | |
| Tribromoacetic Acid SCHEMBL6912748 | 0.67 | — | — | |
| Tribromoacetic Acid SCHEMBL6915772 | 0.67 | — | — | |
| SCHEMBL751842 | 0.67 | — | — | |
| Tribromoacetic Acid SCHEMBL6909811 | 0.67 | — | — | |
| Tribromoacetic Acid SCHEMBL6916357 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180265467-A1 | PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS | SELVITA S.A. (PL) | 2018-09-20 | — | — | US | disclosed |