⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL580181 | 0.97 | — | — | |
| Ether SCHEMBL7256702 | 0.89 | LMNA (0.41) | — | |
| Ether SCHEMBL3439244 | 0.89 | LMNA (0.41) | — | |
| SCHEMBL9117965 | 0.79 | — | — | |
| Ethyl Acetate SCHEMBL4462178 | 0.78 | ALDH1A1 (0.56) | — | |
| SCHEMBL7730742 | 0.77 | LMNA (0.60) | — | |
| Hydrochloric Acid SCHEMBL29114426 | 0.73 | — | — | |
| SCHEMBL13409663 | 0.71 | — | — | |
| SCHEMBL195701 | 0.71 | — | — | |
| SCHEMBL3318330 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8435978-B2 | Substituted sulfonamide compounds | GRUENENTHAL GMBH (DE) | 2013-05-07 | — | — | US | disclosed |
| US-20100324009-A1 | Substituted Sulfonamide Compounds | GRUENENTHAL GMBH (DE) | 2010-12-23 | — | — | US | disclosed |
| US-20100317644-A1 | Substituted Sulfonamide Compounds | GRUENENTHAL GMBH (DE) | 2010-12-16 | — | — | US | disclosed |
| US-20080153843-A1 | SUBSTITUTED SULFONAMIDE COMPOUNDS | GRUENENTHAL GMBH (DE) | 2008-06-26 | — | — | US | disclosed |