⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4939354 | 0.88 | — | — | |
| SCHEMBL8944333 | 0.86 | — | — | |
| SCHEMBL2420966 | 0.83 | — | — | |
| SCHEMBL5016055 | 0.79 | — | — | |
| SCHEMBL5015685 | 0.79 | — | — | |
| SCHEMBL16280362 | 0.79 | — | — | |
| SCHEMBL513814 | 0.79 | — | — | |
| SCHEMBL247603 | 0.79 | — | — | |
| SCHEMBL183520 | 0.78 | SIGMAR1 (0.32) | — | |
| SCHEMBL9388510 | 0.76 | — | — |
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-4152346-A | FROM BETA-HALOETHYLSILANES AND AMMONIA, ADHESIVES | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) | 1979-05-01 | — | — | US | disclosed |