⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6357374 | 1.00 | — | — | |
| SCHEMBL6357376 | 1.00 | — | — | |
| SCHEMBL7353889 | 0.97 | ALDH1A1 (0.48) | — | |
| SCHEMBL6200897 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL6200895 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL18300402 | 0.78 | ALDH1A1 (0.42) | — | |
| SCHEMBL258859 | 0.78 | — | — | |
| SCHEMBL18300403 | 0.78 | ALDH1A1 (0.42) | — | |
| SCHEMBL6297993 | 0.78 | — | — | |
| SCHEMBL490428 | 0.78 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9012127-B2 | Thermoreversible network scaffolds and methods of preparing same | THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) | 2015-04-21 | — | — | US | disclosed |
| EP-1288720-B1 | Plate-making method of printing plate | FUJIFILM CORP (JP) | 2012-02-01 | — | — | EP | disclosed |