⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14218658 | 0.85 | — | — | |
| SCHEMBL11756453 | 0.85 | — | — | |
| SCHEMBL17835268 | 0.83 | MAPT (0.34) | — | |
| SCHEMBL12488334 | 0.83 | MAPT (0.34) | — | |
| SCHEMBL17835272 | 0.83 | MAPT (0.34) | — | |
| SCHEMBL17835271 | 0.83 | MAPT (0.34) | — | |
| SCHEMBL19517328 | 0.77 | — | — | |
| SCHEMBL27265511 | 0.77 | — | — | |
| SCHEMBL4402767 | 0.77 | GAA (0.32) | — | |
| SCHEMBL4942467 | 0.75 | — | — |
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-2426124-A1 | PROCESS FOR PRODUCING PYRIPYROPENE DERIVATIVE | Meiji Seika Pharma Co., Ltd. (JP) | 2012-03-07 | — | — | EP | disclosed |
| US-20110245514-A1 | PROCESSES FOR THE PRODUCTION OF HYDROGENATED PRODUCTS | BIOAMBER S.A.S. (CA) | 2011-10-06 | — | — | US | disclosed |
| EP-2371798-A1 | Processes for the production of tetrahydrofuran, gamma-butyrolactone and/or butanediol from salts of succinic acid | BioAmber S.A.S. (CA) | 2011-10-05 | — | — | EP | disclosed |