⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8630720 | 0.71 | — | — | |
| SCHEMBL8014456 | 0.69 | AKR1B1 (0.53) | — | |
| SCHEMBL8014451 | 0.69 | AKR1B1 (0.53) | — | |
| SCHEMBL6014660 | 0.69 | — | — | |
| SCHEMBL15013806 | 0.67 | — | — | |
| SCHEMBL15013805 | 0.67 | — | — | |
| SCHEMBL66720 | 0.67 | — | — | |
| SCHEMBL7568579 | 0.64 | — | — | |
| SCHEMBL10702346 | 0.64 | — | — | |
| SCHEMBL22833843 | 0.64 | — | — |
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-20010034333-A1 | Cyclodextrin polymer compositions for use as drug carriers | KOSAK KENNETH M (US) | 2001-10-25 | — | — | US | disclosed |