⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4969030 | 1.00 | — | — | |
| SCHEMBL4549129 | 1.00 | — | — | |
| SCHEMBL5489375 | 0.96 | — | — | |
| SCHEMBL5489373 | 0.96 | — | — | |
| SCHEMBL23170009 | 0.86 | — | — | |
| SCHEMBL14946733 | 0.86 | — | — | |
| SCHEMBL24070452 | 0.86 | — | — | |
| SCHEMBL15433917 | 0.81 | — | — | |
| SCHEMBL13187093 | 0.81 | — | — | |
| SCHEMBL10057929 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20130052349-A1 | ORGANOMETALLIC COMPOUNDS | PRAXAIR TECHNOLOGY, INC. | 2013-02-28 | — | — | US | claimed |
| US-20070299274-A1 | Organometallic compounds | PRAXAIR TECHNOLOGY, INC. | 2007-12-27 | — | — | US | claimed |
| US-20130052349-A1 | ORGANOMETALLIC COMPOUNDS | PRAXAIR TECHNOLOGY, INC. | 2013-02-28 | — | — | US | disclosed |
| US-20130047890-A1 | ORGANOMETALLIC COMPOUNDS | PRAXAIR TECHNOLOGY, INC. | 2013-02-28 | — | — | US | disclosed |
| US-8318966-B2 | Organometallic compounds | PRAXAIR TECHNOLOGY, INC. (US) | 2012-11-27 | — | — | US | disclosed |
| WO-2008002415-A2 | PRECURSORS FOR DEPOSITING SILICON CONTAINING FILMS AND PROCESSES THEREOF | PRAXAIR TECHNOLOGY, INC. (US) | 2008-01-03 | — | — | WO | disclosed |
| US-20070299274-A1 | Organometallic compounds | PRAXAIR TECHNOLOGY, INC. | 2007-12-27 | — | — | US | disclosed |