⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20117218 | 0.82 | ALDH1A1 (0.32) | — | |
| SCHEMBL20117212 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL18513184 | 0.75 | — | — | |
| SCHEMBL25581284 | 0.75 | SIGMAR1 (0.33) | — | |
| SCHEMBL18513207 | 0.74 | — | — | |
| SCHEMBL18513286 | 0.74 | — | — | |
| SCHEMBL25893778 | 0.72 | TDP1 (0.32) | — | |
| SCHEMBL20171237 | 0.71 | — | — | |
| SCHEMBL25996312 | 0.70 | — | — | |
| SCHEMBL25816767 | 0.69 | SIGMAR1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3015494-B1 | FLAME-RETARDANT SHEET OR FILM, PRODUCTS COMPRISING THE SAME AND PROCESS FOR PRODUCTION THEREOF | MITSUBISHI GAS CHEMICAL CO (JP) | 2018-05-02 | — | — | EP | disclosed |