⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20937669 | 0.66 | ALDH1A1 (0.45) | — | |
| SCHEMBL20718809 | 0.62 | — | — | |
| Calcium Chloride SCHEMBL21625034 | 0.57 | INMT (0.45) | — | |
| SCHEMBL716666 | 0.49 | — | — | |
| SCHEMBL10982343 | 0.40 | — | — | |
| SCHEMBL649682 | 0.40 | ALDH1A1 (0.37) | — | |
| Thiophene SCHEMBL8584833 | 0.36 | — | — | |
| SCHEMBL31325568 | 0.36 | — | — | |
| SCHEMBL83540 | 0.36 | — | — | |
| Thiophene SCHEMBL1493745 | 0.36 | — | — |
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-20200157338-A1 | SELF-POLISHING ZWITTERIONIC ANTI-FOULING RESIN HAVING MAIN CHAIN DEGRADABILITY AND PREPARATION THEREFOR AND USE THEREOF | SOUTH CHINA UNIVERSITY OF TECHNOLOGY (CN) | 2020-05-21 | — | — | US | disclosed |