⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11684199 | 0.83 | KCNH2 (0.33) | — | |
| SCHEMBL11684202 | 0.83 | KCNH2 (0.33) | — | |
| SCHEMBL4334223 | 0.78 | — | — | |
| SCHEMBL16901565 | 0.77 | — | — | |
| SCHEMBL30832 | 0.76 | — | — | |
| SCHEMBL23422693 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL15901538 | 0.76 | TSHR (0.32) | — | |
| Hydrochloric Acid SCHEMBL22771780 | 0.74 | KCNH2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL22771713 | 0.74 | TSHR (0.31) | — | |
| Hydrochloric Acid SCHEMBL22771779 | 0.74 | KCNH2 (0.30) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5196138-A | Reacting alkyllithium and amines | CYPRUS FOOTE MINERAL COMPANY (US) | 1993-03-23 | — | — | US | disclosed |
| US-5173209-A | Concentrated solvent reagent; high solubility; chemical intermediates for steroids and fragrance | CYPRUS FOOTE MINERAL COMPANY (US) | 1992-12-22 | — | — | US | disclosed |
| US-5149457-A | In monocyclic aromatic solvent; ether-free | CYPRUS FOOTE MINERAL COMPANY (US) | 1992-09-22 | — | — | US | disclosed |
| EP-0423087-A2 | Mixed lithium amides and reagent compositions thereof | CYPRUS FOOTE MINERAL COMPANY (US) | 1991-04-17 | — | — | EP | disclosed |
| EP-0406197-A2 | Stable lithium amides and reagent compositions thereof | CYPRUS FOOTE MINERAL COMPANY (US) | 1991-01-02 | — | — | EP | disclosed |