⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12826939 | 0.76 | — | — | |
| SCHEMBL19829639 | 0.72 | — | — | |
| SCHEMBL10029107 | 0.59 | CTRB1 (0.33) | — | |
| SCHEMBL15268936 | 0.59 | — | — | |
| SCHEMBL8732502 | 0.56 | — | — | |
| SCHEMBL381203 | 0.56 | LMNA (0.50) | — | |
| SCHEMBL18734769 | 0.55 | KMT2A (0.39) | — | |
| SCHEMBL6444342 | 0.55 | HMGCR (0.31) | — | |
| SCHEMBL381033 | 0.54 | LMNA (0.55) | — | |
| SCHEMBL6656860 | 0.54 | HSD11B1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018019549-A1 | DIOXOLANONE INTERMEDIATE USEFUL IN THE SYNTHESIS OF HOMOHARRINGTONINE | INDENA S.P.A. (IT) | 2018-02-01 | — | — | WO | disclosed |
| EP-3275875-A1 | DIOXOLANONE INTERMEDIATE USEFUL IN THE SYNTHESIS OF HOMOHARRINGTONINE | INDENA S.p.A. (IT) | 2018-01-31 | — | — | EP | disclosed |