⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL319456 | 0.94 | — | — | |
| SCHEMBL8676820 | 0.91 | — | — | |
| SCHEMBL27742664 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL28222226 | 0.88 | — | — | |
| SCHEMBL27925654 | 0.86 | KDM4E (0.31) | — | |
| SCHEMBL28232209 | 0.83 | AXL (0.32) | — | |
| Ammonia Solution, Strong SCHEMBL28201786 | 0.81 | — | — | |
| Pyrrole SCHEMBL27815823 | 0.81 | POLB (0.35) | — | |
| Pyrrole SCHEMBL27742668 | 0.79 | POLB (0.34) | — | |
| Thiocyanic Acid SCHEMBL28232215 | 0.78 | — | — |
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-103450242-B | Organoaminodisilane precursors and methods of thin film deposition comprising the same | 弗萨姆材料美国有限责任公司 | 2018-05-01 | — | — | CN | disclosed |