⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5804646 | 0.79 | — | — | |
| SCHEMBL12097276 | 0.78 | MPO (0.35) | — | |
| SCHEMBL17267204 | 0.76 | — | — | |
| SCHEMBL18933659 | 0.76 | DAO (0.45) | — | |
| SCHEMBL20201720 | 0.75 | HMBS (0.37) | — | |
| SCHEMBL23888882 | 0.73 | MAOA (0.43) | — | |
| SCHEMBL13233368 | 0.72 | — | — | |
| SCHEMBL3538776 | 0.72 | — | — | |
| SCHEMBL23241465 | 0.72 | — | — | |
| SCHEMBL3415097 | 0.72 | NPSR1 (0.48) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109662961-A | For improving the method and composition of cognitive function | 约翰斯霍普金斯大学 | 2019-04-23 | — | — | CN | disclosed |
| CN-109662964-A | For improving the method and composition of cognitive function | 约翰斯.霍普金斯大学 | 2019-04-23 | — | — | CN | disclosed |
| WO-2018098204-A1 | 6-MEMBERED URACIL ISOSTERES | CV6 THERAPEUTICS (NI) LIMITED (GB) | 2018-05-31 | — | — | WO | disclosed |