⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23419428 | 0.93 | — | — | |
| SCHEMBL23419443 | 0.92 | — | — | |
| SCHEMBL23419185 | 0.83 | P2RY2 (0.32) | — | |
| SCHEMBL23419186 | 0.82 | P2RY2 (0.33) | — | |
| SCHEMBL23419142 | 0.80 | — | — | |
| SCHEMBL24548685 | 0.78 | P2RY2 (0.35) | — | |
| SCHEMBL26082650 | 0.78 | POLB (0.34) | — | |
| SCHEMBL20021614 | 0.78 | P2RY2 (0.32) | — | |
| SCHEMBL14806824 | 0.78 | P2RY2 (0.32) | — | |
| SCHEMBL20383456 | 0.78 | P2RY2 (0.32) | — |
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-12031178-B2 | Cyclooctatetraene containing dyes and compositions | ILLUMINA CAMBRIDGE LIMITED (GB) | 2024-07-09 | — | — | US | disclosed |
| US-20230265502-A1 | CYCLOOCTATETRAENE CONTAINING DYES AND COMPOSITIONS | ILLUMINA CAMBRIDGE LIMITED (GB) | 2023-08-24 | — | — | US | disclosed |