⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28066038 | 1.00 | — | — | |
| SCHEMBL16504 | 0.85 | HCAR2 (0.40) | — | |
| SCHEMBL16505 | 0.85 | HCAR2 (0.40) | — | |
| SCHEMBL16503 | 0.85 | HCAR2 (0.40) | — | |
| SCHEMBL25405178 | 0.85 | HCAR2 (0.40) | — | |
| SCHEMBL25405174 | 0.85 | HCAR2 (0.40) | — | |
| SCHEMBL832203 | 0.82 | HCAR2 (0.45) | — | |
| SCHEMBL27942656 | 0.82 | HCAR2 (0.38) | — | |
| SCHEMBL21955999 | 0.82 | HCAR2 (0.45) | — | |
| SCHEMBL7568618 | 0.82 | HCAR2 (0.42) | — |
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-110326139-A | Energy device electrode resin, energy device composition for electrode formation, energy device electrode and energy device | 日立化成株式会社 | 2019-10-11 | — | — | CN | disclosed |
| CN-110326138-A | Energy device electrode resin, energy device composition for electrode formation, energy device electrode and energy device | 日立化成株式会社 | 2019-10-11 | — | — | CN | disclosed |