⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19090077 | 0.80 | — | — | |
| SCHEMBL19734422 | 0.76 | — | — | |
| SCHEMBL19710416 | 0.76 | — | — | |
| SCHEMBL22456311 | 0.76 | — | — | |
| SCHEMBL31680397 | 0.76 | — | — | |
| SCHEMBL19090080 | 0.76 | — | — | |
| SCHEMBL19050838 | 0.76 | — | — | |
| SCHEMBL31680338 | 0.76 | — | — | |
| SCHEMBL10019571 | 0.73 | — | — | |
| SCHEMBL8316376 | 0.73 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2684880-B1 | DISPIROPYRROLIDINE DERIVATIVE | DAIICHI SANKYO CO LTD (JP) | 2018-02-28 | — | — | EP | disclosed |