⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10895362 | 0.96 | TRPA1 (0.38) | — | |
| SCHEMBL15302 | 0.96 | — | — | |
| SCHEMBL28341893 | 0.96 | — | — | |
| SCHEMBL26134 | 0.96 | — | — | |
| SCHEMBL432583 | 0.96 | — | — | |
| SCHEMBL325087 | 0.96 | TRPA1 (0.38) | — | |
| Hydrochloric Acid SCHEMBL5798467 | 0.92 | — | — | |
| SCHEMBL6696460 | 0.92 | ALDH1A1 (0.39) | — | |
| SCHEMBL21436120 | 0.92 | — | — | |
| Methane SCHEMBL21357925 | 0.92 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1212953-B1 | Watertight shoe | SYMPATEX TECHNOLOGIES GMBH (DE) | 2006-01-25 | — | — | EP | disclosed |
| EP-1212953-A2 | Watertight shoe | Sympatex Technologies GmbH (DE) | 2002-06-12 | — | — | EP | disclosed |
| US-4418698-A | Ultrasonic scanning probe with mechanical sector scanning means | DORY JACQUES (FR) | 1983-12-06 | — | — | US | disclosed |
| US-3969298-A | Selected lipophilic aminimides and polymers derived therefrom useful for making stable emulsions | THE KENDALL COMPANY (US) | 1976-07-13 | — | — | US | disclosed |