⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL35875 | 0.95 | — | — | |
| SCHEMBL27817181 | 0.90 | — | — | |
| Water SCHEMBL26665767 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL11026631 | 0.90 | — | — | |
| SCHEMBL29280529 | 0.90 | — | — | |
| Dimethylamine SCHEMBL15260753 | 0.82 | — | — | |
| Cyclopentane SCHEMBL28428949 | 0.82 | — | — | |
| Butadiene SCHEMBL1240104 | 0.63 | — | — | |
| Fluoride SCHEMBL27913016 | 0.63 | — | — | |
| Fluoride SCHEMBL27913014 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115558399-A | Weather-resistant electrochromic coating and preparation method thereof | 江苏中新瑞光学材料有限公司 | 2023-01-03 | — | — | CN | disclosed |
| CN-111875959-A | Building template material and preparation method thereof | 康亚男 | 2020-11-03 | — | — | CN | disclosed |