⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11212398 | 1.00 | — | — | |
| SCHEMBL3762623 | 0.82 | ALDH1A1 (0.42) | — | |
| SCHEMBL23713595 | 0.74 | — | — | |
| SCHEMBL1346222 | 0.72 | — | — | |
| SCHEMBL845011 | 0.72 | — | — | |
| SCHEMBL1562705 | 0.72 | — | — | |
| SCHEMBL3423272 | 0.72 | — | — | |
| SCHEMBL23713564 | 0.70 | — | — | |
| SCHEMBL572269 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL18327141 | 0.70 | — | — |
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-20210238318-A1 | COMPOSITE FUNCTIONAL RESIN, PREPARATION METHOD THEREFOR AND USE THEREOF | NANJING UNIVERSITY & YANCHENG ACADEMY OF ENVIRONMENTAL PROTECTION TECHNOLOGY AND ENGINEERING (CN) | 2021-08-05 | — | — | US | disclosed |