⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22673285 | 0.73 | — | — | |
| SCHEMBL20007589 | 0.72 | — | — | |
| SCHEMBL21256197 | 0.72 | — | — | |
| SCHEMBL19430859 | 0.71 | — | — | |
| SCHEMBL18673173 | 0.68 | — | — | |
| SCHEMBL25636494 | 0.68 | — | — | |
| SCHEMBL23052620 | 0.68 | — | — | |
| SCHEMBL20851476 | 0.68 | — | — | |
| SCHEMBL13824418 | 0.68 | ALDH1A1 (0.31) | — | |
| SCHEMBL24064825 | 0.68 | — | — |
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-8152511-B2 | Composition to reduce adhesion between a conformable region and a mold | MOLECULAR IMPRINTS, INC. (US) | 2012-04-10 | — | — | US | disclosed |
| US-20110215503-A1 | Reducing Adhesion between a Conformable Region and a Mold | MOLECULAR IMPRINTS, INC. (US) | 2011-09-08 | — | — | US | disclosed |
| US-20090272875-A1 | Composition to Reduce Adhesion Between a Conformable Region and a Mold | MOLECULAR IMPRINTS, INC. (US) | 2009-11-05 | — | — | US | disclosed |