⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8888138 | 0.88 | — | — | |
| SCHEMBL8888509 | 0.88 | FOS (0.30) | — | |
| SCHEMBL8888401 | 0.88 | — | — | |
| SCHEMBL8887896 | 0.86 | — | — | |
| SCHEMBL8887113 | 0.84 | — | — | |
| SCHEMBL8887672 | 0.82 | PTGS1 (0.30) | — | |
| SCHEMBL8889414 | 0.82 | — | — | |
| SCHEMBL8888572 | 0.81 | — | — | |
| SCHEMBL8886953 | 0.81 | — | — | |
| SCHEMBL8887993 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997003961-A1 | IMIDO PEROXIDES AS INITIATORS OF POLYMERIZATION PROCESSES | AKZO NOBEL N.V. (NL) | 1997-02-06 | — | — | WO | disclosed |