⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4865125 | 0.80 | — | — | |
| SCHEMBL1783345 | 0.80 | — | — | |
| Hydrogen Peroxide SCHEMBL27141842 | 0.78 | ALDH1A1 (0.36) | — | |
| SCHEMBL11390901 | 0.77 | ALDH1A1 (0.38) | — | |
| SCHEMBL27943 | 0.76 | — | — | |
| SCHEMBL28380109 | 0.76 | — | — | |
| SCHEMBL9049421 | 0.76 | ALDH1A1 (0.38) | — | |
| Hydrochloric Acid SCHEMBL28275073 | 0.74 | HSD17B10 (0.33) | — | |
| SCHEMBL8401323 | 0.74 | — | — | |
| SCHEMBL8401327 | 0.74 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116868434-A | Separator for secondary battery | 株式会社LG新能源 | 2023-10-10 | — | — | CN | disclosed |
| CN-112930376-A | Combination of water-based primer composition and ink, and printed matter | 阪田油墨股份有限公司 | 2021-06-08 | — | — | CN | disclosed |
| CN-1122192-C | Image forming apparatus including contact charging member | CANON KK (JP) | 2003-09-24 | — | — | CN | disclosed |
| CN-1164054-A | Image forming apparatus including contact charging member | CANON KK (JP) | 1997-11-05 | — | — | CN | disclosed |
| US-4063878-A | Applying sublimation indicia to pressure-sensitive adhesive tape | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1977-12-20 | — | — | US | disclosed |