⚠ 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL9699780 | 0.68 | — | — | |
| SCHEMBL11609279 | 0.63 | — | — | |
| SCHEMBL9601345 | 0.60 | — | — | |
| SCHEMBL575368 | 0.56 | — | — | |
| SCHEMBL1691032 | 0.56 | — | — | |
| SCHEMBL5884621 | 0.55 | — | — | |
| SCHEMBL12520988 | 0.54 | — | — | |
| SCHEMBL4052707 | 0.54 | — | — | |
| SCHEMBL19100784 | 0.54 | — | — | |
| SCHEMBL8277496 | 0.54 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1658099-B1 | COMPOUNDS AND KITS FOR PREPARING IMAGING AGENTS AND METHODS OF IMAGING | GEN ELECTRIC (US) | 2008-09-10 | — | — | EP | disclosed |
| US-20050049487-A1 | Compounds and kits for preparing imaging agents and methods of imaging | GENERAL ELECTRIC COMPANY | 2005-03-03 | — | — | US | disclosed |
| US-5025016-A | Mucolytic agents | LUDWIG HEUMANN & CO. GMBH (DE) | 1991-06-18 | — | — | US | disclosed |
| EP-0124630-B1 | PYRIMIDINETHIOALKYL PYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS | LUDWIG HEUMANN & CO GMBH (DE) | 1987-01-28 | — | — | EP | disclosed |
| EP-0124630-A1 | Pyrimidinethioalkyl pyridine derivatives, process for their preparation and medicines containing these compounds | LUDWIG HEUMANN & CO GMBH (DE) | 1984-11-14 | — | — | EP | disclosed |