⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8412766 | 0.71 | — | — | |
| SCHEMBL3072589 | 0.67 | — | — | |
| SCHEMBL7190100 | 0.58 | — | — | |
| SCHEMBL9172189 | 0.52 | — | — | |
| SCHEMBL525491 | 0.51 | — | — | |
| SCHEMBL8619869 | 0.51 | — | — | |
| SCHEMBL207424 | 0.51 | — | — | |
| SCHEMBL22634 | 0.51 | — | — | |
| SCHEMBL8846724 | 0.50 | — | — | |
| Hydrochloric Acid SCHEMBL23581440 | 0.48 | — | — |
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-6756465-B1 | ALKOXYSILANE FUNCTIONAL URETHANE COMPOUNDS HAVING HYDROLYZABLE ALKOXYSILANE GROUPS ANCHORED ON FLEXIBLE BACKBONE | HENKEL LOCTITE CORPORATION | 2004-06-29 | — | — | US | disclosed |