⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15200738 | 0.99 | — | — | |
| SCHEMBL726783 | 0.85 | — | — | |
| SCHEMBL21905439 | 0.84 | — | — | |
| SCHEMBL15200733 | 0.84 | — | — | |
| SCHEMBL29175441 | 0.82 | MAPT (0.40) | — | |
| SCHEMBL12043836 | 0.81 | — | — | |
| SCHEMBL29175447 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL28353888 | 0.79 | — | — | |
| SCHEMBL29175444 | 0.79 | ALDH1A1 (0.38) | — | |
| SCHEMBL724894 | 0.78 | LMNA (0.34) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9184390-B2 | Polymers with tunable band gaps for photonic and electronic applications | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2015-11-10 | — | — | US | disclosed |
| US-20130092912-A1 | POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS | NAVY, SECRETARY OF THE UNITED STATES OF AMERICA | 2013-04-18 | — | — | US | disclosed |
| WO-2011156478-A2 | POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2011-12-15 | — | — | WO | disclosed |