⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31747937 | 0.74 | — | — | |
| SCHEMBL15066694 | 0.72 | — | — | |
| SCHEMBL2499428 | 0.72 | — | — | |
| SCHEMBL7617702 | 0.70 | — | — | |
| SCHEMBL28418372 | 0.70 | — | — | |
| SCHEMBL7523496 | 0.70 | — | — | |
| SCHEMBL6509363 | 0.70 | — | — | |
| SCHEMBL7187124 | 0.70 | — | — | |
| SCHEMBL7668067 | 0.67 | — | — | |
| SCHEMBL7174401 | 0.67 | — | — |
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-110431197-A | Laminating inks | TIGER COATINGS GMBH & CO KG | 2019-11-08 | — | — | CN | disclosed |