⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13734952 | 0.97 | MEN1 (0.58) | — | |
| SCHEMBL9951247 | 0.97 | MEN1 (0.56) | — | |
| SCHEMBL14266911 | 0.97 | MEN1 (0.56) | — | |
| SCHEMBL15803251 | 0.97 | MEN1 (0.58) | — | |
| SCHEMBL2428341 | 0.97 | MEN1 (0.56) | — | |
| SCHEMBL9951659 | 0.95 | MEN1 (0.60) | — | |
| SCHEMBL414527 | 0.95 | MEN1 (0.60) | — | |
| SCHEMBL6888802 | 0.95 | MEN1 (0.60) | — | |
| SCHEMBL965611 | 0.95 | MEN1 (0.60) | — | |
| SCHEMBL4167594 | 0.95 | MEN1 (0.60) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021039749-A1 | TWO-COMPONENT-TYPE RESIN COMPOSITION FOR HEAT-RADIATING MATERIAL | 株式会社日本触媒 | 2021-03-04 | — | — | WO | disclosed |