⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21657393 | 0.97 | DNM1 (0.60) | — | |
| SCHEMBL21127241 | 0.97 | DNM1 (0.60) | — | |
| SCHEMBL15384977 | 0.97 | DNM1 (0.60) | — | |
| SCHEMBL15384949 | 0.97 | — | — | |
| SCHEMBL15384940 | 0.97 | DNM1 (0.60) | — | |
| Fluoride SCHEMBL10786063 | 0.94 | DNM1 (0.57) | — | |
| SCHEMBL10269768 | 0.90 | — | — | |
| SCHEMBL16492084 | 0.87 | ALDH1A1 (0.44) | — | |
| SCHEMBL18625794 | 0.80 | S1PR2 (0.38) | — | |
| SCHEMBL514807 | 0.78 | DNM1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3151327-B1 | ELECTROLYTE SOLUTION | DAIKIN IND LTD (JP) | 2019-05-08 | — | — | EP | disclosed |
| US-8008252-B2 | Factor VII: remodeling and glycoconjugation of Factor VII | NOVO NORDISK A/S (DK) | 2011-08-30 | — | — | US | disclosed |