⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1499780 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL27297651 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28039730 | 0.71 | — | — | |
| SCHEMBL15561553 | 0.70 | — | — | |
| SCHEMBL6636053 | 0.68 | — | — | |
| Bromide SCHEMBL28203662 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL28281372 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL27596084 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL29161649 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL28983241 | 0.63 | — | — |
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-4174220-A | DIHYDROXYDIPHENYL COMPOUND AND 2,2'-SPIROBI(2H-1-BENZOPYRAN) DERIVATIVE | KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) | 1979-11-13 | — | — | US | disclosed |