⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25014337 | 0.86 | — | — | |
| SCHEMBL24997136 | 0.82 | — | — | |
| SCHEMBL24996480 | 0.78 | — | — | |
| SCHEMBL24997157 | 0.78 | — | — | |
| SCHEMBL23284287 | 0.78 | — | — | |
| SCHEMBL24996484 | 0.78 | — | — | |
| SCHEMBL24996479 | 0.78 | — | — | |
| SCHEMBL23284280 | 0.78 | — | — | |
| SCHEMBL24759643 | 0.74 | GPR35 (0.31) | — | |
| SCHEMBL24759359 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023012363-A1 | PHOTOACTIVE NONFULLERENE ACCEPTORS OF THE A-D-A'-D-A TYPE FOR USE IN OPTOELECTRONIC DEVICES | CAMBRIDGE DISPLAY TECHNOLOGY LTD. (GB) | 2023-02-09 | — | — | WO | disclosed |