⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8941769 | 1.00 | — | — | |
| SCHEMBL6884828 | 0.74 | — | — | |
| SCHEMBL28632093 | 0.71 | TRPA1 (0.30) | — | |
| SCHEMBL28636449 | 0.71 | TRPA1 (0.30) | — | |
| SCHEMBL6886965 | 0.66 | — | — | |
| SCHEMBL23203046 | 0.66 | CHRNA7 (0.31) | — | |
| SCHEMBL1539574 | 0.66 | LMNA (0.34) | — | |
| SCHEMBL20292375 | 0.61 | — | — | |
| SCHEMBL11391085 | 0.60 | TSHR (0.37) | — | |
| SCHEMBL3746366 | 0.59 | ALDH1A1 (0.37) | — |
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-5503781-A | POLYMERIZATION OF MELAMINE-FORMALDEHYDE RESIN TO ENCAPSULATE EMULSIFIED HYDROPHOBIC CORE MATERIAL IN AQUEOUS SOLUTION OF ELECTROLYTE COMPRISING MALEIC ANHYDRIDE-VINYLTOLUENESULFONIC ACID AND MALEIC ANHYDRIDE-METHYL VINYL ETHER COPOLYMERS | SAKURA COLOR PRODUCTS CORPORATION (JP) | 1996-04-02 | — | — | US | disclosed |