⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11772255 | 0.75 | — | — | |
| SCHEMBL11101890 | 0.75 | — | — | |
| SCHEMBL5238215 | 0.75 | ALDH1A1 (0.45) | — | |
| SCHEMBL10499617 | 0.74 | — | — | |
| SCHEMBL10499613 | 0.74 | — | — | |
| SCHEMBL7072234 | 0.73 | — | — | |
| SCHEMBL27420035 | 0.72 | — | — | |
| SCHEMBL28507815 | 0.72 | — | — | |
| SCHEMBL4536559 | 0.71 | ALDH1A1 (0.41) | — | |
| SCHEMBL15121006 | 0.71 | ALDH1A1 (0.41) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120057100-A1 | OPTICAL MEMBERS AND DEVICES EMPLOYING THE SAME | 3M INNOVATIVE PROPERTIES COMPANY | 2012-03-08 | — | — | US | disclosed |
| WO-2010135213-A2 | OPTICAL MEMBERS AND DEVICES EMPLOYING THE SAME | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2010-11-25 | — | — | WO | disclosed |