⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15785195 | 1.00 | — | — | |
| SCHEMBL15785196 | 0.96 | — | — | |
| SCHEMBL19472358 | 0.94 | — | — | |
| SCHEMBL19718304 | 0.92 | — | — | |
| SCHEMBL25916578 | 0.89 | — | — | |
| SCHEMBL25916566 | 0.89 | — | — | |
| SCHEMBL25488780 | 0.89 | — | — | |
| SCHEMBL18195184 | 0.89 | — | — | |
| SCHEMBL16658932 | 0.87 | — | — | |
| SCHEMBL25451141 | 0.86 | — | — |
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-20160322575-A1 | POLYMER/FULLERENE FORMATIONS AND THEIR USE IN ELECTRONIC/PHOTONIC DEVICES | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2016-11-03 | — | — | US | disclosed |