⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL786395 | 0.78 | NOS3 (0.31) | — | |
| SCHEMBL890082 | 0.73 | — | — | |
| SCHEMBL10197111 | 0.71 | — | — | |
| SCHEMBL12248415 | 0.71 | — | — | |
| SCHEMBL668578 | 0.71 | — | — | |
| SCHEMBL6797394 | 0.71 | — | — | |
| SCHEMBL2263513 | 0.71 | — | — | |
| SCHEMBL30197664 | 0.69 | HAO1 (0.31) | — | |
| SCHEMBL20713862 | 0.68 | — | — | |
| SCHEMBL23026171 | 0.68 | — | — |
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-2023107673-A2 | CLEAVABLE DISULFIDE LINKERS AND USES THEREOF | Singular Genomics Systems, Inc. (US) | 2023-06-15 | — | — | WO | disclosed |