⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL34730 | 0.93 | — | — | |
| SCHEMBL27827998 | 0.93 | — | — | |
| Iodide SCHEMBL410829 | 0.90 | — | — | |
| Fluoride SCHEMBL635145 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL194565 | 0.90 | — | — | |
| Water SCHEMBL23500113 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL6297793 | 0.90 | — | — | |
| Bromide SCHEMBL28213295 | 0.90 | — | — | |
| Methane SCHEMBL27778951 | 0.90 | — | — | |
| SCHEMBL28143565 | 0.90 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106457909-B | Tire | 株式会社普利司通 | 2018-12-07 | — | — | CN | disclosed |
| CN-106457909-A | Tire | 株式会社普利司通 | 2017-02-22 | — | — | CN | disclosed |