⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5583540 | 1.00 | — | — | |
| SCHEMBL6935890 | 0.72 | — | — | |
| SCHEMBL815557 | 0.72 | — | — | |
| SCHEMBL18271 | 0.72 | — | — | |
| SCHEMBL21808753 | 0.72 | — | — | |
| SCHEMBL29204341 | 0.72 | — | — | |
| SCHEMBL8013873 | 0.72 | — | — | |
| SCHEMBL10673598 | 0.67 | — | — | |
| Water SCHEMBL852727 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL3458500 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5612421-A | PAIN PRIMER, VINYLTRIALKOXYSILANE WITH MALEIC ANHYDRIDE OR ACRYLIC ACID | BETZDEARBORN INC. (US) | 1997-03-18 | — | — | US | disclosed |
| US-5518770-A | ZINC OR ZIRCONIUM SALT HYDROLYSATE OF MALEIC ANHYDRIDE-TRIETHOXYVINYLSILANE COPOLYMER | BETZ LABORATORIES, INC. (US) | 1996-05-21 | — | — | US | disclosed |