⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23869450 | 0.78 | — | — | |
| SCHEMBL20068712 | 0.73 | — | — | |
| SCHEMBL22479093 | 0.69 | — | — | |
| SCHEMBL25045418 | 0.69 | — | — | |
| SCHEMBL24706904 | 0.69 | — | — | |
| SCHEMBL24248234 | 0.69 | — | — | |
| SCHEMBL21913789 | 0.69 | — | — | |
| SCHEMBL14617059 | 0.69 | — | — | |
| SCHEMBL25237192 | 0.66 | TSHR (0.30) | — | |
| SCHEMBL269926 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001010561-A1 | BLOWING AGENT FOR FLOTATION OF MINERAL PRODUCTS AND METHOD FOR THE PRODUCTION THEREOF | ZAKRYTOE AKTSIONERNOE OBSCHESTVO 'EVROFINCHERMETKHOLDING' (RU) | 2001-02-15 | — | — | WO | disclosed |
| WO-2001010560-A1 | COMPOSITION USED FOR THE FLOTATION OF MINERAL PRODUCTS | ZAKRYTOE AKTSIONERNOE OBSCHESTVO 'EVROFINCHERMETHKOLDING' (RU) | 2001-02-15 | — | — | WO | disclosed |