⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29008238 | 0.57 | — | — | |
| SCHEMBL7872220 | 0.57 | — | — | |
| SCHEMBL9939311 | 0.55 | TSHR (0.33) | — | |
| SCHEMBL343650 | 0.54 | — | — | |
| SCHEMBL1702393 | 0.47 | — | — | |
| SCHEMBL9557664 | 0.47 | — | — | |
| SCHEMBL10146751 | 0.45 | — | — | |
| SCHEMBL5919405 | 0.45 | — | — | |
| SCHEMBL465635 | 0.45 | — | — | |
| SCHEMBL1176563 | 0.45 | — | — |
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-106883810-A | A kind of exfoliated polyurethane binder high | 江苏华大新材料有限公司 | 2017-06-23 | — | — | CN | disclosed |