⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL989999 | 0.84 | — | — | |
| Iodide SCHEMBL28281005 | 0.81 | — | — | |
| Water SCHEMBL27913319 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL8498790 | 0.79 | TRIM24 (0.35) | — | |
| SCHEMBL13654345 | 0.72 | — | — | |
| SCHEMBL13766597 | 0.67 | — | — | |
| SCHEMBL23264489 | 0.67 | — | — | |
| SCHEMBL12071480 | 0.67 | — | — | |
| SCHEMBL3431850 | 0.67 | — | — | |
| SCHEMBL6561816 | 0.67 | — | — |
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-20210147478-A1 | INHIBITORS OF BLOOD COAGULATION FACTOR XIII | ZEDIRA GMBH (DE) | 2021-05-20 | — | — | US | disclosed |
| WO-2010041194-A1 | TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS | ACTELION PHARMACEUTICALS LTD (CH) | 2010-04-15 | — | — | WO | disclosed |