⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12831347 | 1.00 | — | — | |
| SCHEMBL20099336 | 0.83 | ALDH1A1 (0.30) | — | |
| SCHEMBL18569926 | 0.77 | — | — | |
| SCHEMBL22580830 | 0.75 | — | — | |
| SCHEMBL19661047 | 0.73 | — | — | |
| SCHEMBL12455695 | 0.73 | — | — | |
| SCHEMBL17578579 | 0.72 | TRPA1 (0.31) | — | |
| SCHEMBL29346534 | 0.71 | — | — | |
| SCHEMBL12015980 | 0.71 | — | — | |
| SCHEMBL13515549 | 0.71 | — | — |
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-20100214373-A1 | AUTHENTICATING A PRODUCT | AUTHENTIX, INC. (US) | 2010-08-26 | — | — | US | disclosed |
| EP-2183115-A2 | AUTHENTICATING A PRODUCT | Authentix, Inc. (US) | 2010-05-12 | — | — | EP | disclosed |
| WO-2009017506-A2 | AUTHENTICATING A PRODUCT | AUTHENTIX, INC. (US) | 2009-02-05 | — | — | WO | disclosed |