⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25688990 | 0.79 | HPGD (0.32) | — | |
| SCHEMBL6849169 | 0.76 | TSHR (0.34) | — | |
| SCHEMBL28909840 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL731565 | 0.74 | — | — | |
| SCHEMBL11100893 | 0.74 | — | — | |
| SCHEMBL61154 | 0.73 | LMNA (0.32) | — | |
| SCHEMBL9620140 | 0.72 | — | — | |
| SCHEMBL9620213 | 0.72 | — | — | |
| SCHEMBL24082950 | 0.71 | MEN1 (0.35) | — | |
| SCHEMBL633633 | 0.71 | MEN1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2231482-A | — | — | None | — | — | JP | disclosed |
| US-5108740-A | Biodegradable films; sustained release | ECOLAB INC. (US) | 1992-04-28 | — | — | US | disclosed |
| JP-H02231482-A | ANTIMICROBIAL FILM-FORMING COMPOSITION | ECOLAB INC | 1990-09-13 | — | — | JP | disclosed |