⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10224499 | 1.00 | — | — | |
| SCHEMBL6467972 | 1.00 | — | — | |
| SCHEMBL11660018 | 0.95 | — | — | |
| SCHEMBL8528723 | 0.74 | — | — | |
| Glycerin SCHEMBL27639360 | 0.73 | LMNA (0.75) | — | |
| SCHEMBL1963565 | 0.70 | — | — | |
| SCHEMBL16305594 | 0.70 | LMNA (0.50) | — | |
| SCHEMBL14528962 | 0.70 | — | — | |
| SCHEMBL17177581 | 0.70 | LMNA (0.41) | — | |
| SCHEMBL7584024 | 0.70 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2655330-B1 | SUBSTITUTED PYRIDINES AS SODIUM CHANNEL BLOCKERS | PURDUE PHARMA LP (US) | 2016-02-10 | — | — | EP | disclosed |
| EP-2902387-A1 | ASCORBIC ACID-RELATED COMPOUND AND ANTI-PLANT-VIRUS AGENT | Nippon Soda Co., Ltd. (JP) | 2015-08-05 | — | — | EP | disclosed |
| WO-2015112801-A1 | PYRIDINES AND PYRIMIDINES AND USE THEREOF | PURDUE PHARMA L.P. (US) | 2015-07-30 | — | — | WO | disclosed |
| WO-2015099841-A1 | INDAZOLES AND USE THEREOF | PURDUE PHARMA L.P. (US) | 2015-07-02 | — | — | WO | disclosed |
| WO-2015094443-A1 | PYRIMIDINES AND USE THEREOF | PURDUE PHARMA L.P. (US) | 2015-06-25 | — | — | WO | disclosed |
| EP-2625169-B1 | QUINAZOLINE COMPOUNDS AS SODIUM CHANNEL BLOCKERS | PURDUE PHARMA LP (US) | 2015-03-25 | — | — | EP | disclosed |
| EP-2582666-B1 | ARYL SUBSTITUTED INDOLES AND THEIR USE AS BLOCKERS OF SODIUM CHANNELS | PURDUE PHARMA LP (US) | 2014-08-13 | — | — | EP | disclosed |
| WO-2013072758-A1 | PYRIMIDINE DIOL AMIDES AS SODIUM CHANNEL BLOCKERS | PURDUE PHARMA L.P. (US) | 2013-05-23 | — | — | WO | disclosed |
| WO-2012085650-A1 | SUBSTITUTED PYRIDINES AS SODIUM CHANNEL BLOCKERS | PURDUE PHARMA L.P. (US) | 2012-06-28 | — | — | WO | disclosed |
| WO-2011158108-A2 | ARYL SUBSTITUTED INDOLES AND THE USE THEREOF | PURDUE PHARMA L.P. (US) | 2011-12-22 | — | — | WO | disclosed |