⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29005987 | 0.81 | CA12 (0.37) | — | |
| SCHEMBL9065612 | 0.79 | — | — | |
| SCHEMBL8589288 | 0.77 | — | — | |
| SCHEMBL19185976 | 0.75 | — | — | |
| SCHEMBL4782152 | 0.72 | — | — | |
| SCHEMBL8438465 | 0.72 | — | — | |
| SCHEMBL11319044 | 0.72 | — | — | |
| SCHEMBL23870203 | 0.70 | — | — | |
| SCHEMBL9635534 | 0.70 | — | — | |
| SCHEMBL3593911 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107109284-A | Mixed phosphorus esters for lubricant applications | 路博润公司 | 2017-08-29 | — | — | CN | disclosed |