⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL887897 | 0.79 | — | — | |
| SCHEMBL3651955 | 0.79 | — | — | |
| SCHEMBL4109384 | 0.79 | — | — | |
| SCHEMBL28977830 | 0.77 | — | — | |
| SCHEMBL28070074 | 0.74 | — | — | |
| SCHEMBL25174752 | 0.74 | — | — | |
| SCHEMBL23925813 | 0.71 | LMNA (0.31) | — | |
| SCHEMBL23925665 | 0.69 | CES1 (0.36) | — | |
| SCHEMBL13715915 | 0.67 | CES2 (0.39) | — | |
| SCHEMBL73470 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4136067-A1 | ODORANTS AND COMPOSITIONS COMPRISING ODORANTS | S H Kelkar and Company Limited (IN) | 2023-02-22 | — | — | EP | disclosed |
| WO-2021209944-A1 | ODORANTS AND COMPOSITIONS COMPRISING ODORANTS | S H KELKAR AND COMPANY LIMITED (IN) | 2021-10-21 | — | — | WO | disclosed |