⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30803015 | 0.78 | — | — | |
| SCHEMBL19840697 | 0.78 | — | — | |
| SCHEMBL27566854 | 0.78 | GRM4 (0.31) | — | |
| SCHEMBL10438934 | 0.74 | — | — | |
| SCHEMBL11782762 | 0.74 | — | — | |
| SCHEMBL127483 | 0.74 | SLC1A2 (0.33) | — | |
| Iodide SCHEMBL8074782 | 0.73 | SLC1A2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL29273219 | 0.73 | SLC1A2 (0.33) | — | |
| Bromide SCHEMBL8072905 | 0.73 | SLC1A2 (0.33) | — | |
| Water SCHEMBL27749086 | 0.73 | SLC1A2 (0.33) | — |
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-102471443-B | Urethane foam for use in automobile seats and method for producing same | TOYO QUALITY ONE CORP | 2014-04-09 | — | — | CN | disclosed |
| CN-102471443-A | Polyurethane foam for automobile seat and method for producing same | TOYO QUALITY ONE CORP | 2012-05-23 | — | — | CN | disclosed |