⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16555814 | 0.77 | BHMT (0.56) | — | |
| SCHEMBL24153347 | 0.77 | BHMT (0.39) | — | |
| SCHEMBL7592069 | 0.71 | TDP1 (0.33) | — | |
| SCHEMBL17790051 | 0.69 | — | — | |
| SCHEMBL9863044 | 0.68 | GABRR1 (0.43) | — | |
| SCHEMBL18175928 | 0.68 | — | — | |
| SCHEMBL1271400 | 0.67 | — | — | |
| SCHEMBL16306519 | 0.67 | — | — | |
| SCHEMBL14700166 | 0.67 | — | — | |
| SCHEMBL2553592 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2090323-A1 | Protein-Proteophor Complexes | Complex Biosystems GmbH (DE) | 2009-08-19 | — | — | EP | disclosed |