⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5898967 | 0.93 | — | — | |
| SCHEMBL12465789 | 0.91 | — | — | |
| SCHEMBL12465634 | 0.79 | — | — | |
| SCHEMBL1672494 | 0.70 | — | — | |
| SCHEMBL8462650 | 0.70 | — | — | |
| SCHEMBL14830971 | 0.68 | — | — | |
| SCHEMBL4861123 | 0.59 | — | — | |
| SCHEMBL3419762 | 0.57 | — | — | |
| SCHEMBL1606812 | 0.57 | — | — | |
| SCHEMBL235343 | 0.56 | — | — |
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-3279211-B1 | UNNATURAL AMINO ACIDS COMPRISING A NORBORNENYL GROUP AND USES THEREOF | EMBL (DE) | 2020-04-29 | — | — | EP | disclosed |
| EP-3279211-A1 | UNNATURAL AMINO ACIDS COMPRISING A NORBORNENYL GROUP AND USES THEREOF | EMBL (DE) | 2018-02-07 | — | — | EP | disclosed |
| EP-2670767-B1 | UNNATURAL AMINO ACIDS COMPRISING A CYCLOOCTYNYL OR TRANS-CYCLOOCTENYL ANALOG GROUP AND USES THEREOF | EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) | 2017-12-20 | — | — | EP | disclosed |
| US-9085514-B2 | Unnatural amino acids comprising a cyclooctynyl or trans-cyclooctenyl analog group and uses thereof | EMBL (DE) | 2015-07-21 | — | — | US | disclosed |
| US-20140073764-A1 | UNNATURAL AMINO ACIDS COMPRISING A CYCLOOCTYNYL OR TRANS-CYCLOOCTENYL ANALOG GROUP AND USES THEREOF | EMBL (DE) | 2014-03-13 | — | — | US | disclosed |
| EP-2670767-A1 | UNNATURAL AMINO ACIDS COMPRISING A CYCLOOCTYNYL OR TRANS-CYCLOOCTENYL ANALOG GROUP AND USES THEREOF | EMBL (DE) | 2013-12-11 | — | — | EP | disclosed |
| WO-2012104422-A1 | UNNATURAL AMINO ACIDS COMPRISING A CYCLOOCTYNYL OR TRANS-CYCLOOCTENYL ANALOG GROUP AND USES THEREOF | EMBL (DE) | 2012-08-09 | — | — | WO | disclosed |