⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16669269 | 0.68 | INMT (0.59) | — | |
| SCHEMBL960885 | 0.67 | — | — | |
| SCHEMBL8230279 | 0.67 | — | — | |
| SCHEMBL29476198 | 0.66 | HTR2C (0.37) | — | |
| SCHEMBL3839499 | 0.65 | — | — | |
| SCHEMBL7573495 | 0.65 | HRH1 (0.38) | — | |
| SCHEMBL30645717 | 0.65 | — | — | |
| SCHEMBL26605355 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL29476689 | 0.65 | HTR2C (0.36) | — | |
| Hydrochloric Acid SCHEMBL7573222 | 0.64 | ALDH1A1 (0.38) | — |
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-8263598-B2 | Substituted sulfonamide compounds | GRUENENTHAL GMBH (DE) | 2012-09-11 | — | — | US | disclosed |
| US-7638513-B2 | Compounds for the treatment of inflammatory disorders | SCHERING CORPORATION (US) | 2009-12-29 | — | — | US | disclosed |
| US-20090186899-A1 | Substituted Sulfonamide Compounds | GRUENENTHAL GMBH (DE) | 2009-07-23 | — | — | US | disclosed |
| US-20060178366-A1 | Compounds for the treatment of inflammatory disorders | SCHERING CORPORATION | 2006-08-10 | — | — | US | disclosed |