⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4122534 | 0.74 | DGAT1 (0.35) | — | |
| SCHEMBL10231407 | 0.71 | TSHR (0.33) | — | |
| SCHEMBL74184 | 0.68 | — | — | |
| SCHEMBL15259062 | 0.65 | — | — | |
| SCHEMBL14051461 | 0.64 | LMNA (0.33) | — | |
| SCHEMBL19524492 | 0.64 | — | — | |
| SCHEMBL16329754 | 0.64 | — | — | |
| SCHEMBL1843680 | 0.64 | — | — | |
| SCHEMBL17075241 | 0.62 | — | — | |
| SCHEMBL73300 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10421923-B2 | Lubricant composition containing an antiwear agent | THE LUBRIZOL CORPORATION (US) | 2019-09-24 | — | — | US | disclosed |