⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22240372 | 0.77 | — | — | |
| SCHEMBL22240390 | 0.75 | — | — | |
| SCHEMBL22240396 | 0.70 | — | — | |
| SCHEMBL22240378 | 0.69 | — | — | |
| SCHEMBL23809587 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL23809603 | 0.68 | — | — | |
| SCHEMBL20107356 | 0.66 | — | — | |
| SCHEMBL23809613 | 0.65 | KDM4E (0.33) | — | |
| SCHEMBL22240377 | 0.65 | — | — | |
| SCHEMBL22240379 | 0.61 | TSHR (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3532578-B1 | LUBRICANT ADDITIVE COMPOSITIONS COMPRISING PHOSPHOROUS CONTAINING COMPOUNDS AND USES THEREOF | AFTON CHEMICAL CORP (US) | 2021-09-15 | — | — | EP | disclosed |