⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23005218 | 0.85 | — | — | |
| SCHEMBL23005220 | 0.84 | — | — | |
| SCHEMBL23005201 | 0.77 | KMT2A (0.44) | — | |
| SCHEMBL23005255 | 0.67 | — | — | |
| SCHEMBL6064104 | 0.65 | — | — | |
| SCHEMBL23005219 | 0.64 | KMT2A (0.36) | — | |
| SCHEMBL23005228 | 0.64 | SIGMAR1 (0.39) | — | |
| SCHEMBL13573110 | 0.63 | — | — | |
| SCHEMBL3840421 | 0.62 | — | — | |
| SCHEMBL6063258 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11174275-B2 | Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use | DREXEL UNIVERSITY (US) | 2021-11-16 | — | — | US | disclosed |
| US-20210054003-A1 | Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use | DREXEL UNIVERSITY | 2021-02-25 | — | — | US | disclosed |