⚠ 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 | |
|---|---|---|---|---|
| Isopropylamine SCHEMBL366379 | 0.88 | — | — | |
| Methylamine SCHEMBL11207129 | 0.79 | — | — | |
| SCHEMBL331376 | 0.78 | — | — | |
| SCHEMBL579981 | 0.77 | — | — | |
| Isopropylamine SCHEMBL354242 | 0.76 | GABRP (0.31) | — | |
| Hydrochloric Acid SCHEMBL6928174 | 0.74 | — | — | |
| SCHEMBL21635408 | 0.74 | — | — | |
| SCHEMBL21635359 | 0.74 | — | — | |
| SCHEMBL21753865 | 0.74 | — | — | |
| SCHEMBL8020725 | 0.74 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102341088-B | Curable composition for dental use and composite resin using same | KURARAY MEDICAL INC | 2014-02-19 | — | — | CN | disclosed |
| CN-102014847-B | Dental composition and composite resin | KURARAY MEDICAL INC | 2013-12-04 | — | — | CN | disclosed |
| CN-102083403-B | Dental composition and composite resin | KURARAY MEDICAL INC | 2013-10-09 | — | — | CN | disclosed |
| CN-102014848-B | Dental composition and composite resin | KURARAY MEDICAL INC | 2013-06-19 | — | — | CN | disclosed |
| CN-102341088-A | Curable composition for dental use and composite resin using same | KURARAY MEDICAL INC | 2012-02-01 | — | — | CN | disclosed |
| CN-102083403-A | Dental composition and composite resin | KURARAY MEDICAL INC | 2011-06-01 | — | — | CN | disclosed |
| CN-102014847-A | Dental composition and composite resin | KURARAY MEDICAL INC | 2011-04-13 | — | — | CN | disclosed |
| CN-102014848-A | Dental composition and composite resin | KURARAY MEDICAL INC | 2011-04-13 | — | — | CN | disclosed |