⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15438041 | 1.00 | — | — | |
| SCHEMBL2130855 | 1.00 | — | — | |
| SCHEMBL2131546 | 1.00 | — | — | |
| SCHEMBL3931630 | 1.00 | — | — | |
| SCHEMBL8847309 | 0.98 | — | — | |
| SCHEMBL15438047 | 0.92 | — | — | |
| SCHEMBL15437652 | 0.91 | TSHR (0.32) | — | |
| SCHEMBL29265978 | 0.86 | — | — | |
| SCHEMBL31621176 | 0.80 | LMNA (0.35) | — | |
| SCHEMBL31621181 | 0.80 | LMNA (0.35) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8946364-B2 | Solution phase polydiacetylene synthesis by alkyne metathesis | EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) | 2015-02-03 | — | — | US | claimed |
| US-20140031506-A1 | SOLUTION PHASE POLYDIACETYLENE SYNTHESIS BY ALKYNE METATHESIS | EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) | 2014-01-30 | — | — | US | claimed |
| WO-2014018021-A1 | SOLUTION PHASE POLYDIACETYLENE SYNTHESIS BY ALKYNE METATHESIS | EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) | 2014-01-30 | — | — | WO | claimed |
| CN-103732650-B | Polycarbonate resin, coating liquid containing same, and molded article molded using same | 出光兴产株式会社 | 2016-06-08 | — | — | CN | disclosed |
| CN-105121525-A | Coating liquid, laminate, optical device, and electronic device | IDEMITSU KOSAN CO | 2015-12-02 | — | — | CN | disclosed |
| US-8946364-B2 | Solution phase polydiacetylene synthesis by alkyne metathesis | EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) | 2015-02-03 | — | — | US | disclosed |
| WO-2014018021-A1 | SOLUTION PHASE POLYDIACETYLENE SYNTHESIS BY ALKYNE METATHESIS | EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) | 2014-01-30 | — | — | WO | disclosed |
| US-20140031506-A1 | SOLUTION PHASE POLYDIACETYLENE SYNTHESIS BY ALKYNE METATHESIS | EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) | 2014-01-30 | — | — | US | disclosed |