⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16569032 | 1.00 | — | — | |
| SCHEMBL1812662 | 1.00 | — | — | |
| SCHEMBL9764915 | 1.00 | — | — | |
| SCHEMBL1812664 | 1.00 | — | — | |
| Water SCHEMBL3790782 | 0.82 | — | — | |
| SCHEMBL6579139 | 0.82 | — | — | |
| SCHEMBL8621004 | 0.82 | — | — | |
| Fluoride SCHEMBL11439061 | 0.82 | — | — | |
| Fluoride SCHEMBL11439065 | 0.82 | — | — | |
| Water SCHEMBL21247123 | 0.82 | — | — |
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-5013523-A | Mixing aluminum /alloy/ powder with aluminum borate whisker with lithium hydroxide or vinyl silane on surface, and pressure molding and firing, or firing under compression | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) | 1991-05-07 | — | — | US | disclosed |