⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL970731 | 0.77 | — | — | |
| SCHEMBL28891738 | 0.77 | — | — | |
| SCHEMBL9108100 | 0.77 | — | — | |
| SCHEMBL1719882 | 0.77 | — | — | |
| SCHEMBL4429608 | 0.77 | — | — | |
| SCHEMBL6751597 | 0.77 | — | — | |
| Fluoride SCHEMBL27533548 | 0.75 | — | — | |
| SCHEMBL28966216 | 0.71 | — | — | |
| SCHEMBL27931102 | 0.69 | — | — | |
| SCHEMBL705590 | 0.69 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10005706-B2 | Chiral siliceous composition useful as chiral heterogeneous catalyst and a process for the preparation thereof | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2018-06-26 | — | — | US | claimed |
| US-10005706-B2 | Chiral siliceous composition useful as chiral heterogeneous catalyst and a process for the preparation thereof | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2018-06-26 | — | — | US | disclosed |
| US-20160251287-A1 | Chiral Siliceous Composition Useful as Chiral Heterogeneous Catalyst and a Process for the Preparation Thereof | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2016-09-01 | — | — | US | disclosed |
| CN-101798323-B | N-halamine siloxanes for use in biocidal coatings and materials | UNIV AUBURN | 2014-01-22 | — | — | CN | disclosed |
| CN-101967351-A | Heterocyclic halamine-substituted siloxanes for use in biocidal coatings and materials | UNIV AUBURN | 2011-02-09 | — | — | CN | disclosed |
| US-20110009547-A1 | RUBBER COMPOSITION FOR A TYRE COMPRISING A HYDROXYSILANE COVERING AGENT | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2011-01-13 | — | — | US | disclosed |
| CN-101798323-A | N-halamine siloxanes for use in biocidal coatings and materials | UNIV AUBURN | 2010-08-11 | — | — | CN | disclosed |
| CN-100590127-C | Heterocyclic halamine siloxanes for use in biocidal coatings and materials | UNIV AUBURN | 2010-02-17 | — | — | CN | disclosed |
| CN-1675227-A | Heterocyclic halamine siloxanes for use in biocidal coatings and materials | UNIV AUBURN (US) | 2005-09-28 | — | — | CN | disclosed |