⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12721088 | 0.67 | MGLL (0.38) | — | |
| SCHEMBL8025929 | 0.56 | SMN1; SMN2 (0.51) | — | |
| SCHEMBL11912416 | 0.55 | PLA2G2C (0.38) | — | |
| SCHEMBL21761328 | 0.55 | OPRM1 (0.33) | — | |
| SCHEMBL10106996 | 0.55 | ALDH1A1 (0.38) | — | |
| SCHEMBL5394039 | 0.54 | SIGMAR1 (0.42) | — | |
| SCHEMBL10654652 | 0.54 | SMN1; SMN2 (0.56) | — | |
| SCHEMBL422585 | 0.54 | — | — | |
| SCHEMBL1861994 | 0.54 | — | — | |
| SCHEMBL12795884 | 0.54 | L3MBTL1 (0.52) | — |
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-20100092483-A1 | Compositions monovalent for CD40L binding and methods of use | DOMANTIS LIMITED | 2010-04-15 | — | — | US | disclosed |