⚠ 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 | |
|---|---|---|---|---|
| Propene SCHEMBL15902550 | 1.00 | TP53 (0.44) | — | |
| Acrylic Acid SCHEMBL11573171 | 0.84 | LMNA (0.62) | — | |
| Lactic Acid SCHEMBL1517824 | 0.84 | — | — | |
| Methylmalonic Acid SCHEMBL8428740 | 0.84 | TP53 (0.42) | — | |
| SCHEMBL29030831 | 0.84 | — | — | |
| Acetaldehyde SCHEMBL8145563 | 0.83 | TP53 (0.47) | — | |
| Acetaldehyde SCHEMBL50446 | 0.83 | — | — | |
| Isobutane SCHEMBL27894360 | 0.83 | LMNA (0.41) | — | |
| Ethylene SCHEMBL27404109 | 0.82 | — | — | |
| Formaldehyde SCHEMBL5282207 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113165015-B | Weather-resistant hard coating composition for glass-substitute substrate, cured product, and laminate | 株式会社大赛璐 | 2023-11-28 | — | — | CN | disclosed |
| CN-113228207-B | Rare earth magnet precursor or rare earth magnet molded body having roughened structure on surface, and method for producing same | 大赛璐美华株式会社 | 2023-08-01 | — | — | CN | disclosed |
| CN-101971409-B | Non-aqueous electrolyte for a lithium battery, lithium battery wherein said electrolyte is used, and hydroxy-acid derivative for use in said electrolyte | UBE INDUSTRIES | 2013-06-19 | — | — | CN | disclosed |