⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24052084 | 0.79 | CA2 (0.46) | — | |
| SCHEMBL4192920 | 0.74 | — | — | |
| SCHEMBL14384884 | 0.74 | — | — | |
| SCHEMBL5406214 | 0.74 | — | — | |
| SCHEMBL302815 | 0.74 | — | — | |
| SCHEMBL14385210 | 0.74 | — | — | |
| SCHEMBL1419639 | 0.74 | — | — | |
| SCHEMBL14385219 | 0.74 | — | — | |
| SCHEMBL22133125 | 0.74 | — | — | |
| SCHEMBL8278995 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992002513-A1 | HETEROCYCLIC COMPOUNDS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-02-20 | — | — | WO | claimed |