⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5049188 | 0.90 | — | — | |
| SCHEMBL16995921 | 0.86 | — | — | |
| SCHEMBL238099 | 0.86 | — | — | |
| SCHEMBL313294 | 0.86 | ADRB2 (0.32) | — | |
| SCHEMBL9657891 | 0.86 | — | — | |
| SCHEMBL23483313 | 0.86 | — | — | |
| SCHEMBL9656868 | 0.86 | — | — | |
| SCHEMBL18316479 | 0.86 | — | — | |
| SCHEMBL5045815 | 0.85 | ADRB2 (0.34) | — | |
| SCHEMBL5140653 | 0.85 | ADRB2 (0.36) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1392640-B1 | CYCLOALKANECARBOXYLIC ACID DERIVATIVES AS FRAGRANTS WITH MUSK CHARACTERISTICS | GIVAUDAN SA (CH) | 2007-12-19 | — | — | EP | claimed |
| US-20040234568-A1 | Cycloalkanecarboxylic acid derivatives as fragants with musk characteristics | GIVAUDAN SA (CH) | 2004-11-25 | — | — | US | claimed |
| EP-1392640-A1 | CYCLOALKANECARBOXYLIC ACID DERIVATIVES AS FRAGRANTS WITH MUSK CHARACTERISTICS | Givaudan SA (CH) | 2004-03-03 | — | — | EP | claimed |
| WO-2002096852-A1 | CYCLOALKANECARBOXYLIC ACID DERIVATIVES AS FRAGRANTS WITH MUSK CHARACTERISTICS | GIVAUDAN SA (CH) | 2002-12-05 | — | — | WO | claimed |
| EP-1262474-A1 | Cycloalkanecarboxylic acid derivatives as fragrants with musk characteristics | Givaudan SA (CH) | 2002-12-04 | — | — | EP | claimed |
| US-7390779-B2 | Cycloalkanecarboxylic acid derivatives as fragants with musk characteristics | GIVAUDAN SA (CH) | 2008-06-24 | — | — | US | disclosed |
| EP-1392640-B1 | CYCLOALKANECARBOXYLIC ACID DERIVATIVES AS FRAGRANTS WITH MUSK CHARACTERISTICS | GIVAUDAN SA (CH) | 2007-12-19 | — | — | EP | disclosed |
| US-20040234568-A1 | Cycloalkanecarboxylic acid derivatives as fragants with musk characteristics | GIVAUDAN SA (CH) | 2004-11-25 | — | — | US | disclosed |
| EP-1262474-A1 | Cycloalkanecarboxylic acid derivatives as fragrants with musk characteristics | Givaudan SA (CH) | 2002-12-04 | — | — | EP | disclosed |