⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11568465 | 0.72 | — | — | |
| SCHEMBL6059984 | 0.72 | — | — | |
| SCHEMBL4375985 | 0.65 | ALDH1A1 (0.32) | — | |
| SCHEMBL14785130 | 0.65 | — | — | |
| SCHEMBL2769057 | 0.65 | — | — | |
| SCHEMBL1161115 | 0.65 | — | — | |
| SCHEMBL11399994 | 0.65 | — | — | |
| SCHEMBL5398672 | 0.64 | — | — | |
| SCHEMBL2378890 | 0.64 | — | — | |
| SCHEMBL518040 | 0.61 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2054150-A2 | COATED MOLECULAR SIEVE | Nanoscape AG (DE) | 2009-05-06 | — | — | EP | disclosed |
| EP-1044199-B1 | HETEROCYCLIC TOPOISOMERASE POISONS | UNIV RUTGERS (US) | 2008-07-23 | — | — | EP | disclosed |
| WO-2008000457-A2 | COATED MOLECULAR SIEVE | NANOSCAPE AG (DE) | 2008-01-03 | — | — | WO | disclosed |
| EP-1457541-A1 | WATER ABSORBING AGENT, PROCESS FOR ITS PRODUCTION, AND ABSORBERS AND ABSORBENT ARTICLES MADE BY USING THE AGENT | San-Dia Polymers, Ltd. (JP) | 2004-09-15 | — | — | EP | disclosed |
| US-4652574-A | Certain mono-, di- or tri-substituted pyridyl esters of alkane sulfonic acids having insecticidal, acaricidal and nematocidal properties | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1987-03-24 | — | — | US | disclosed |
| EP-0182603-A2 | Alkanesulfonate derivatives useful as an insecticide, acaricide and nematicide | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1986-05-28 | — | — | EP | disclosed |
| EP-0001914-B1 | ANTIBACTERIALLY ACTIVE AMIDES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID AMIDES | BEECHAM GROUP PLC (GB) | 1981-05-20 | — | — | EP | disclosed |