⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6632363 | 0.88 | USP2 (0.35) | — | |
| SCHEMBL31476912 | 0.80 | — | — | |
| SCHEMBL9243667 | 0.78 | — | — | |
| Formaldehyde SCHEMBL28812987 | 0.78 | USP2 (0.33) | — | |
| SCHEMBL7980514 | 0.74 | — | — | |
| SCHEMBL13474815 | 0.74 | — | — | |
| SCHEMBL7992643 | 0.74 | CHRNB2 (0.34) | — | |
| SCHEMBL398797 | 0.74 | — | — | |
| SCHEMBL4285573 | 0.74 | — | — | |
| SCHEMBL62116 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111295204-A | Spiro compounds as malodor counteracting ingredients | 弗门尼舍有限公司 | 2020-06-16 | — | — | CN | claimed |
| CN-111295204-A | Spiro compounds as malodor counteracting ingredients | 弗门尼舍有限公司 | 2020-06-16 | — | — | CN | disclosed |