⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24269492 | 1.00 | — | — | |
| SCHEMBL10273860 | 1.00 | — | — | |
| SCHEMBL3488092 | 1.00 | — | — | |
| SCHEMBL92614 | 1.00 | — | — | |
| SCHEMBL20811096 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL31512340 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL20703248 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL20703247 | 0.91 | — | — | |
| SCHEMBL18830195 | 0.88 | — | — | |
| SCHEMBL25097095 | 0.88 | — | — |
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-20230075095-A1 | POLYPEPTIDES AND THEIR USE | DEFENSE THREAT REDUCTION AGENCY | 2023-03-09 | — | — | US | disclosed |