⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11056222 | 1.00 | — | — | |
| SCHEMBL11055125 | 0.85 | NPC1 (0.33) | — | |
| SCHEMBL11055127 | 0.85 | NPC1 (0.33) | — | |
| SCHEMBL11053030 | 0.85 | — | — | |
| SCHEMBL11057610 | 0.80 | ZDHHC7 (0.31) | — | |
| SCHEMBL11057609 | 0.80 | ZDHHC7 (0.31) | — | |
| SCHEMBL11059461 | 0.77 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL11051506 | 0.77 | — | — | |
| SCHEMBL11059458 | 0.77 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL11051503 | 0.77 | — | — |
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-4487781-A | HEAT RESISTANCE; PHOTOSTABILITY | SANKYO COMPANY LIMITED (JP) | 1984-12-11 | — | — | US | disclosed |