⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL174718 | 0.99 | — | — | |
| SCHEMBL5916338 | 0.97 | — | — | |
| SCHEMBL8986427 | 0.97 | — | — | |
| SCHEMBL4258781 | 0.81 | — | — | |
| SCHEMBL22389533 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL1459237 | 0.75 | — | — | |
| SCHEMBL22389545 | 0.75 | — | — | |
| SCHEMBL29044351 | 0.69 | — | — | |
| SCHEMBL29148789 | 0.69 | — | — | |
| SCHEMBL28518152 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5286887-A | Polymers of metal-complexes of phthalocyanines, porphrins, and crypt and crown compounds; solvent-insoluble oxidation catalysts | REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1994-02-15 | — | — | US | disclosed |