⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL270880 | 0.75 | — | — | |
| SCHEMBL14142896 | 0.74 | USP2 (0.32) | — | |
| SCHEMBL20689759 | 0.64 | TSHR (0.32) | — | |
| SCHEMBL10299295 | 0.64 | DRD2 (0.36) | — | |
| SCHEMBL276809 | 0.64 | TSHR (0.32) | — | |
| SCHEMBL18556781 | 0.64 | — | — | |
| SCHEMBL270311 | 0.62 | TSHR (0.35) | — | |
| SCHEMBL10287210 | 0.62 | ALDH1A1 (0.43) | — | |
| SCHEMBL270274 | 0.62 | ADH1C (0.35) | — | |
| SCHEMBL27417101 | 0.62 | ADH1A (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2313115-B1 | POLYMERIC DELIVERY SYSTEMS FOR ACTIVE AGENTS | JORDAN RAINER (DE) | 2019-05-15 | — | — | EP | disclosed |
| WO-2009156180-A2 | POLYMERIC DELIVERY SYSTEMS FOR ACTIVE AGENTS | Technische Universität München (DE) | 2009-12-30 | — | — | WO | disclosed |