⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2358 | 0.91 | — | — | |
| Bromide SCHEMBL5483269 | 0.88 | — | — | |
| Methane SCHEMBL5734061 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL3231152 | 0.88 | — | — | |
| SCHEMBL179928 | 0.81 | — | — | |
| SCHEMBL5932277 | 0.80 | ODC1 (0.41) | — | |
| SCHEMBL5932528 | 0.80 | ODC1 (0.41) | — | |
| SCHEMBL6413141 | 0.79 | DDAH1 (0.40) | — | |
| SCHEMBL7989464 | 0.79 | DNM1 (0.50) | — | |
| SCHEMBL11652315 | 0.79 | DNM1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108373897-B | Hot melt adhesive composition, method for preparing the same, and vehicle headlamp | 现代摩比斯株式会社 | 2021-03-05 | — | — | CN | disclosed |