⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12464340 | 0.72 | — | — | |
| SCHEMBL6019555 | 0.68 | — | — | |
| SCHEMBL14136470 | 0.68 | — | — | |
| SCHEMBL24228227 | 0.68 | — | — | |
| SCHEMBL24228239 | 0.67 | CA1 (0.33) | — | |
| SCHEMBL24228237 | 0.67 | CA1 (0.33) | — | |
| SCHEMBL15779800 | 0.67 | CA1 (0.33) | — | |
| SCHEMBL23421839 | 0.65 | — | — | |
| SCHEMBL2541924 | 0.64 | CRBN (0.36) | — | |
| SCHEMBL2545075 | 0.64 | CRBN (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230312476-A1 | COMPOUNDS WITH SEMIOCHEMICAL PROPERTIES AND BIOSENSORS | ROTHAMSTED RESEARCH LIMITED (GB) | 2023-10-05 | — | — | US | disclosed |
| US-20230312476-A1 | COMPOUNDS WITH SEMIOCHEMICAL PROPERTIES AND BIOSENSORS | ROTHAMSTED RESEARCH LIMITED (GB) | 2023-10-05 | — | — | US | disclosed |
| WO-2022023572-A2 | COMPOUNDS WITH SEMIOCHEMICAL PROPERTIES AND BIOSENSORS | ROTHAMSTED RESEARCH LIMITED (GB) | 2022-02-03 | — | — | WO | disclosed |