⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10496497 | 0.89 | — | — | |
| SCHEMBL30447222 | 0.89 | — | — | |
| SCHEMBL706110 | 0.89 | — | — | |
| SCHEMBL31405181 | 0.80 | — | — | |
| SCHEMBL3384687 | 0.80 | — | — | |
| SCHEMBL31405179 | 0.80 | — | — | |
| SCHEMBL509797 | 0.80 | — | — | |
| SCHEMBL9979297 | 0.80 | — | — | |
| SCHEMBL31542486 | 0.80 | — | — | |
| SCHEMBL3384266 | 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 |
|---|---|---|---|---|---|---|---|
| CN-101883826-A | Security pigment | MERCK PATENT GMBH | 2010-11-10 | — | — | CN | disclosed |