⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1579546 | 0.86 | TAAR1 (0.34) | — | |
| SCHEMBL2408218 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL15391208 | 0.70 | — | — | |
| SCHEMBL614445 | 0.68 | ALDH1A1 (0.49) | — | |
| SCHEMBL49499 | 0.67 | — | — | |
| SCHEMBL6332012 | 0.66 | TRPA1 (0.43) | — | |
| SCHEMBL1033739 | 0.65 | CA2 (0.31) | — | |
| SCHEMBL894746 | 0.65 | ALDH1A1 (0.30) | — | |
| SCHEMBL1411796 | 0.65 | — | — | |
| SCHEMBL5437398 | 0.65 | — | — |
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-H2280-H1 | Ionomeric sheeting in roll form and process for producing same | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2013-08-06 | — | — | US | disclosed |
| EP-2350704-A1 | CONCENTRATOR SOLAR CELL MODULES WITH LIGHT CONCENTRATING ARTICLES COMPRISING IONOMERIC MATERIALS | E. I. du Pont de Nemours and Company (US) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010062947-A1 | CONCENTRATOR SOLAR CELL MODULES WITH LIGHT CONCENTRATING ARTICLES COMPRISING IONOMERIC MATERIALS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-06-03 | — | — | WO | disclosed |