⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27843545 | 0.76 | ACACB (0.33) | — | |
| SCHEMBL4919744 | 0.68 | CYP2D6 (0.35) | — | |
| SCHEMBL4924806 | 0.66 | CYP2D6 (0.46) | — | |
| SCHEMBL62097 | 0.66 | — | — | |
| SCHEMBL4201803 | 0.65 | CYP2D6 (0.41) | — | |
| SCHEMBL27894315 | 0.64 | TSHR (0.33) | — | |
| SCHEMBL27621001 | 0.63 | ALDH1A1 (0.39) | — | |
| SCHEMBL28717776 | 0.63 | NR5A1 (0.42) | — | |
| SCHEMBL436762 | 0.62 | — | — | |
| SCHEMBL16671916 | 0.62 | KDM4E (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2878613-B1 | Stabilizer for thiol-ene compositions | ALLNEX Belgium SA (BE) | 2016-09-14 | — | — | EP | disclosed |
| WO-2015082244-A1 | STABILIZER FOR THIOL-ENE COMPOSITIONS | ALLNEX BELGIUM , S.A. (BE) | 2015-06-11 | — | — | WO | disclosed |
| EP-2878613-A1 | Stabilizer for thiol-ene compositions | Allnex Belgium, S.A. (BE) | 2015-06-03 | — | — | EP | disclosed |