⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1550826 | 0.62 | — | — | |
| SCHEMBL27485944 | 0.62 | — | — | |
| SCHEMBL1364578 | 0.62 | — | — | |
| Bromide SCHEMBL28296934 | 0.61 | — | — | |
| SCHEMBL2221820 | 0.57 | — | — | |
| SCHEMBL10408559 | 0.57 | — | — | |
| SCHEMBL7082999 | 0.57 | — | — | |
| SCHEMBL3613272 | 0.57 | — | — | |
| SCHEMBL3613274 | 0.57 | — | — | |
| SCHEMBL23610173 | 0.56 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108003160-B | Method for synthesizing [ a ] -cyclized indole derivative | 南京理工大学 | 2020-05-19 | — | — | CN | disclosed |
| WO-2012083048-A2 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2012-06-21 | — | — | WO | disclosed |
| WO-2012083058-A2 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2012-06-21 | — | — | WO | disclosed |
| WO-2012083043-A1 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2012-06-21 | — | — | WO | disclosed |