⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8344802 | 0.97 | ALDH1A1 (0.33) | — | |
| SCHEMBL9137593 | 0.78 | GAA (0.42) | — | |
| SCHEMBL11250788 | 0.78 | TSHR (0.39) | — | |
| SCHEMBL862169 | 0.77 | — | — | |
| SCHEMBL3074860 | 0.77 | — | — | |
| SCHEMBL10817076 | 0.77 | — | — | |
| SCHEMBL8509308 | 0.77 | — | — | |
| SCHEMBL5440136 | 0.77 | — | — | |
| SCHEMBL1820735 | 0.74 | — | — | |
| SCHEMBL10331892 | 0.74 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6040289-A | ACTIVE DRUG TREATING OBESITY | DR. KARL THOMAE GMBH (DE) | 2000-03-21 | — | — | US | disclosed |
| CN-1076199-A | New peptide derivant | ASTRA AB (SE) | 1993-09-15 | — | — | CN | disclosed |
| US-4816583-A | 3- and 5-(bicyclic ether or bicyclic alkylene thioether) alkylene amino thiatriazines | RORER PHARMACEUTICAL CORPORATION (US) | 1989-03-28 | — | — | US | disclosed |
| US-4742055-A | ANTISECRETORY, ANTIULCER | RORER PHARMACEUTICAL CORPORATION (US) | 1988-05-03 | — | — | US | disclosed |
| US-4727169-A | ANTIULCER AGENTS | RORER PHARMACEUTICAL CORPORATION (US) | 1988-02-23 | — | — | US | disclosed |
| US-4704388-A | ANTIULCER, CYTOPROTECTIVE | RORER PHARMACEUTICAL CORPORATION (US) | 1987-11-03 | — | — | US | disclosed |
| EP-0185684-A4 | 3- AND 5- ADBICYCLIC ETHER OR BICYCLIC ALKYLENE THIOETHER BDALKYLENE AMINO THIATRIAZINES, AND THEIR PHARMACEUTICAL USES. | RORER INTERNAT OVERSEAS INC (US) | 1986-09-22 | — | — | EP | disclosed |
| EP-0185684-A1 | 3- AND 5- ADBICYCLIC ETHER OR BICYCLIC ALKYLENE THIOETHER BDALKYLENE AMINO THIATRIAZINES, AND THEIR PHARMACEUTICAL USES | RORER INTERNATIONAL (OVERSEAS) INC. (a Delaware corporation) (US) | 1986-07-02 | — | — | EP | disclosed |
| US-4595683-A | Gastrointestinal disorders, antiulcer agents | WILLIAM H. RORER, INC. (US) | 1986-06-17 | — | — | US | disclosed |
| WO-1985005105-A1 | 3- AND 5- ADBICYCLIC ETHER OR BICYCLIC ALKYLENE THIOETHER BDALKYLENE AMINO THIATRIAZINES, AND THEIR PHARMACEUTICAL USES | RORER INTERNATIONAL (OVERSEAS) INC. (US) | 1985-11-21 | — | — | WO | disclosed |
| US-4353913-A | ANTHELMINTICS | BAYER AKTIENGESELLSCHAFT (DE) | 1982-10-12 | — | — | US | disclosed |
| US-4343648-A | 6H-1,2,4,6-THIATRIAZINE-1,1-DIOXIDES | BASF AKTIENGESELLSCHAFT (DE) | 1982-08-10 | — | — | US | disclosed |
| US-4316014-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1982-02-16 | — | — | US | disclosed |
| US-4316015-A | 6H-1,2,4,6-Thiatriazine-1,1-dioxides | BASF AKTIENGESELLSCHAFT (DE) | 1982-02-16 | — | — | US | disclosed |
| US-4287199-A | USEFUL AS ANTHELMINITICS | BAYER AKTIENGESELLSCHAFT (DE) | 1981-09-01 | — | — | US | disclosed |
| US-4254143-A | PARACITICIDES; LIVER FLUKES | HOECHST AKTIENGESELLSCHAFT (DE) | 1981-03-03 | — | — | US | disclosed |