⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL460908 | 0.83 | — | — | |
| Fluoride SCHEMBL22583589 | 0.80 | GLRA1 (0.41) | — | |
| SCHEMBL30431485 | 0.77 | KDM5B (0.53) | — | |
| SCHEMBL5315508 | 0.77 | — | — | |
| SCHEMBL18037714 | 0.76 | LDHA (0.38) | — | |
| SCHEMBL163295 | 0.75 | — | — | |
| SCHEMBL7943326 | 0.73 | — | — | |
| SCHEMBL1722843 | 0.73 | — | — | |
| SCHEMBL6647114 | 0.73 | — | — | |
| SCHEMBL468780 | 0.73 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105658391-B | The method for producing eye-use lens | 诺华股份有限公司 | 2019-02-19 | — | — | CN | disclosed |
| CN-101568499-B | Aqueous dispersions of precipitated silicas and silicates for increasing the early strength of cementitious formulations | EVONIK DEGUSSA GMBH | 2014-04-23 | — | — | CN | disclosed |
| CN-101568499-A | Aqueous dispersions of precipitated silicas and silicates for increasing the early strength of cementitious formulations | EVONIK DEGUSSA GMBH (DE) | 2009-10-28 | — | — | CN | disclosed |
| EP-0661269-B1 | Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments | HOECHST AG (DE) | 1997-03-26 | — | — | EP | disclosed |
| EP-0650961-B1 | Substituted heterocyclic carboxylic acid amides, their preparation, and their use as medicaments | HOECHST AG (DE) | 1997-03-05 | — | — | EP | disclosed |
| EP-0661269-A1 | Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-07-05 | — | — | EP | disclosed |
| EP-0650961-A1 | Substituted heterocyclic carboxylic acid amides, their preparation, and their use as medicaments | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-05-03 | — | — | EP | disclosed |