⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2009978 | 0.93 | CXCR4 (0.35) | — | |
| SCHEMBL2006001 | 0.86 | — | — | |
| SCHEMBL18432572 | 0.79 | — | — | |
| Methylamine SCHEMBL27943479 | 0.78 | ALOX5 (0.40) | — | |
| SCHEMBL1741781 | 0.77 | — | — | |
| SCHEMBL4720950 | 0.77 | — | — | |
| SCHEMBL29569422 | 0.77 | ALOX15 (0.35) | — | |
| SCHEMBL29569270 | 0.77 | ALOX15 (0.35) | — | |
| SCHEMBL2504572 | 0.76 | ALOX5 (0.49) | — | |
| SCHEMBL9449545 | 0.76 | CXCR4 (0.35) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021143706-A1 | SUBSTITUTED TRIAZINONES AS THYROID HORMONE RECEPTOR AGONISTS | ECCOGENE (SHANGHAI) CO., LTD. (CN) | 2021-07-22 | — | — | WO | disclosed |
| US-7960556-B2 | Thiadiazole derivatives for the treatment of neuro-degenerative diseases | NV REMYND (BE) | 2011-06-14 | — | — | US | disclosed |
| US-20100144709-A1 | THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES | NV REMYND (BE) | 2010-06-10 | — | — | US | disclosed |
| EP-2094677-A1 | THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES | NV Remynd (BE) | 2009-09-02 | — | — | EP | disclosed |
| WO-2008061781-A1 | THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES | NV REMYND (BE) | 2008-05-29 | — | — | WO | disclosed |
| EP-0789062-B1 | WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION | SANYO CHEMICAL IND LTD (JP) | 2003-01-22 | — | — | EP | disclosed |
| US-5994421-A | CROSSLINKING | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 1999-11-30 | — | — | US | disclosed |
| EP-0789062-A1 | WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 1997-08-13 | — | — | EP | disclosed |