⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2080504 | 0.86 | — | — | |
| SCHEMBL25379120 | 0.77 | — | — | |
| SCHEMBL18268934 | 0.73 | — | — | |
| SCHEMBL28018273 | 0.73 | — | — | |
| SCHEMBL19441364 | 0.73 | — | — | |
| SCHEMBL522959 | 0.73 | — | — | |
| SCHEMBL15705535 | 0.73 | — | — | |
| SCHEMBL2078702 | 0.70 | — | — | |
| SCHEMBL5022798 | 0.70 | CYP1A2 (0.50) | — | |
| SCHEMBL23120175 | 0.70 | CYP1A2 (0.42) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20250296918-A1 | METHOD FOR PRODUCING MERCAPTO HETEROCYCLIC COMPOUND AND METHOD FOR TESTING THE SAME | RESONAC CORPORATION (JP) | 2025-09-25 | — | — | US | disclosed |
| WO-2023210608-A1 | PRODUCTION METHOD AND TEST METHOD FOR MERCAPTO HETEROCYCLIC COMPOUND | 株式会社レゾナック | 2023-11-02 | — | — | WO | disclosed |
| US-8961946-B2 | Hair processing agent and method for permanent waving hair | SHOWA DENKO K.K. (JP) | 2015-02-24 | — | — | US | disclosed |
| EP-2024330-B1 | PRODUCTION METHOD OF HETEROCYCLIC MERCAPTO COMPOUND | SHOWA DENKO KK (JP) | 2012-04-25 | — | — | EP | disclosed |
| US-7902383-B2 | Production method of heterocyclic mercapto compound | SHOWA DENKO K.K. (JP) | 2011-03-08 | — | — | US | disclosed |
| US-20090171095-A1 | PRODUCTION METHOD OF HETEROCYCLIC MERCAPTO COMPOUND | SHOWA DENKO K.K. (JP) | 2009-07-02 | — | — | US | disclosed |
| EP-2024330-A1 | PRODUCTION METHOD OF HETEROCYCLIC MERCAPTO COMPOUND | Showa Denko K.K. (JP) | 2009-02-18 | — | — | EP | disclosed |
| US-20080131389-A1 | Hair Relaxer | SHOWA DENKO K.K. (JP) | 2008-06-05 | — | — | US | disclosed |
| US-20080085251-A1 | even at a neutral to weakly acidic pH; a lactone or lactam having a mercapto group; with thioglycolic acid, thiolactic acid, cysteine, acetylcysteine, cysteamine, acylcysteamine; | RESONAC CORPORATION (JP) | 2008-04-10 | — | — | US | disclosed |
| WO-2007139215-A1 | PRODUCTION METHOD OF HETEROCYCLIC MERCAPTO COMPOUND | SHOWA DENKO K.K. (JP) | 2007-12-06 | — | — | WO | disclosed |
| EP-1845940-A1 | HAIR RELAXER | Showa Denko K.K. (JP) | 2007-10-24 | — | — | EP | disclosed |
| EP-1827370-A1 | HAIR PROCESSING AGENT AND METHOD FOR PERMANENT WAVING HAIR | Showa Denko K.K. (JP) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006083031-A1 | HAIR RELAXER | SHOWA DENKO K.K. (JP) | 2006-08-10 | — | — | WO | disclosed |
| WO-2006068276-A1 | HAIR PROCESSING AGENT AND METHOD FOR PERMANENT WAVING HAIR | SHOWA DENKO K.K. (JP) | 2006-06-29 | — | — | WO | disclosed |