⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12993551 | 0.74 | — | — | |
| SCHEMBL13040601 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL13733392 | 0.67 | — | — | |
| SCHEMBL25420174 | 0.65 | — | — | |
| SCHEMBL16111349 | 0.64 | — | — | |
| SCHEMBL16111301 | 0.64 | — | — | |
| SCHEMBL17176458 | 0.62 | — | — | |
| SCHEMBL3615019 | 0.62 | — | — | |
| SCHEMBL19242572 | 0.60 | — | — | |
| SCHEMBL13714893 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20080032913-A1 | Masking of mineral oil odor and fragrancing of mineral oils | SYMRISE GMBH & CO. KG (DE) | 2008-02-07 | — | — | US | claimed |
| EP-1884555-A2 | Masking mineral oil smell and scenting of mineral oils | Symrise GmbH & Co. KG (DE) | 2008-02-06 | — | — | EP | claimed |