⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21028315 | 0.93 | FDPS (0.32) | — | |
| SCHEMBL16349911 | 0.82 | MAPK1 (0.32) | — | |
| SCHEMBL13637547 | 0.82 | — | — | |
| SCHEMBL25448224 | 0.82 | — | — | |
| SCHEMBL19309303 | 0.82 | — | — | |
| SCHEMBL19475932 | 0.80 | FDPS (0.30) | — | |
| SCHEMBL21104978 | 0.78 | — | — | |
| SCHEMBL19733985 | 0.78 | — | — | |
| SCHEMBL23101970 | 0.78 | — | — | |
| SCHEMBL19369792 | 0.78 | FDPS (0.38) | — |
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-20170355930-A1 | CLEANING COMPOSITIONS INCLUDING NUCLEASE ENZYME AND AMINES | THE PROCTER & GAMBLE COMPANY | 2017-12-14 | — | — | US | disclosed |