⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL96140 | 0.85 | ACE2 (0.32) | — | |
| SCHEMBL18687765 | 0.83 | — | — | |
| SCHEMBL23170345 | 0.83 | — | — | |
| SCHEMBL31499508 | 0.83 | ACE2 (0.31) | — | |
| SCHEMBL24201038 | 0.83 | — | — | |
| SCHEMBL9173986 | 0.83 | — | — | |
| SCHEMBL29105339 | 0.83 | ACE2 (0.31) | — | |
| Hydrochloric Acid SCHEMBL9488746 | 0.83 | ACE2 (0.31) | — | |
| SCHEMBL31462132 | 0.81 | — | — | |
| Zinc Ion SCHEMBL31461995 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3939959-A1 | METHOD FOR PRODUCING PEPTIDE COMPOUND | Nissan Chemical Corporation (JP) | 2022-01-19 | — | — | EP | disclosed |