⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11120742 | 0.83 | — | — | |
| SCHEMBL307808 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL50537 | 0.77 | — | — | |
| Fluoride SCHEMBL4618711 | 0.77 | — | — | |
| SCHEMBL7588846 | 0.77 | — | — | |
| Bromide SCHEMBL543270 | 0.77 | — | — | |
| Iodide SCHEMBL2585 | 0.77 | — | — | |
| SCHEMBL25599 | 0.72 | CA2 (0.58) | — | |
| SCHEMBL15109974 | 0.72 | — | — | |
| Iodide SCHEMBL1592185 | 0.72 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6364823-B1 | Methods of and compositions for treating vascular defects | STEREOTAXIS, INC. | 2002-04-02 | — | — | US | disclosed |
| EP-1169081-A1 | METHODS OF AND COMPOSITIONS FOR TREATING VASCULAR DEFECTS | Stereotaxis, Inc. (US) | 2002-01-09 | — | — | EP | disclosed |
| US-6296604-B1 | Methods of and compositions for treating vascular defects | STEREOTAXIS, INC. | 2001-10-02 | — | — | US | disclosed |
| WO-2000054832-A1 | METHODS OF AND COMPOSITIONS FOR TREATING VASCULAR DEFECTS | STEREOTAXIS, INC. (US) | 2000-09-21 | — | — | WO | disclosed |
| CN-1148392-A | Peptide derivative | DAIICHI SEIYAKU CO (JP) | 1997-04-23 | — | — | CN | disclosed |
| US-5280027-A | Quinazoline containing compound | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-01-18 | — | — | US | disclosed |
| EP-0459730-A2 | Anti-tumour compounds | ZENECA LIMITED (GB) | 1991-12-04 | — | — | EP | disclosed |
| EP-0076996-B1 | CARBOXYLIC-ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM | Roche Diagnostics GmbH (DE) | 1986-01-02 | — | — | EP | disclosed |
| US-4443477-A | ANTICOAGULANTS, ANTILIPEMIC AGENTS | BOEHRINGER MANNHEIM GMBH (DE) | 1984-04-17 | — | — | US | disclosed |
| EP-0031954-B1 | SULPHONAMIDES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS | Roche Diagnostics GmbH (DE) | 1984-03-14 | — | — | EP | disclosed |
| EP-0076996-A1 | Carboxylic-acid derivatives, process for their preparation and medicines containing them | Roche Diagnostics GmbH (DE) | 1983-04-20 | — | — | EP | disclosed |
| EP-0031954-A2 | Sulphonamides, process for their preparation and medicines containing these compounds | Roche Diagnostics GmbH (DE) | 1981-07-15 | — | — | EP | disclosed |