⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20499463 | 0.80 | — | — | |
| Tribromoacetic Acid SCHEMBL1331874 | 0.73 | — | — | |
| Tribromoacetic Acid SCHEMBL210187 | 0.73 | — | — | |
| SCHEMBL2128606 | 0.73 | — | — | |
| SCHEMBL1292273 | 0.72 | — | — | |
| Tribromoacetic Acid SCHEMBL6915772 | 0.70 | — | — | |
| Tribromoacetic Acid SCHEMBL6909811 | 0.70 | — | — | |
| Tribromoacetic Acid SCHEMBL4889837 | 0.70 | — | — | |
| Tribromoacetic Acid SCHEMBL6912748 | 0.70 | — | — | |
| SCHEMBL5611022 | 0.70 | ALDH1A1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5847061-A | Process for producing polymers having terminal functional group which may be protected | KURARAY CO., LTD. (JP) | 1998-12-08 | — | — | US | disclosed |
| EP-0704460-B1 | PROCESS FOR PRODUCING POLYMER TERMINATED WITH OPTIONALLY PROTECTED FUNCTIONAL GROUP | KURARAY CO (JP) | 1998-11-04 | — | — | EP | disclosed |
| EP-0704460-A1 | PROCESS FOR PRODUCING POLYMER TERMINATED WITH OPTIONALLY PROTECTED FUNCTIONAL GROUP | KURARAY CO., LTD. (JP) | 1996-04-03 | — | — | EP | disclosed |