⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL247134 | 0.78 | — | — | |
| Charcoal, Activated SCHEMBL7751496 | 0.76 | — | — | |
| SCHEMBL646902 | 0.70 | TRPM8 (0.48) | — | |
| SCHEMBL8965148 | 0.70 | TSHR (0.33) | — | |
| SCHEMBL4818855 | 0.69 | — | — | |
| SCHEMBL13074388 | 0.69 | — | — | |
| SCHEMBL3435804 | 0.67 | TSHR (0.30) | — | |
| SCHEMBL8844699 | 0.65 | MAPT (0.40) | — | |
| SCHEMBL8844554 | 0.65 | ALDH1A1 (0.42) | — | |
| SCHEMBL11207493 | 0.65 | KDM4E (0.45) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101160348-B | Cellulose ester film and method for producing same, optical film, polarizing plate, and liquid crystal display device | KONICA MINOLTA OPTO INC | 2010-12-08 | — | — | CN | disclosed |
| CN-101160348-A | Cellulose ester film and method for producing same, optical film, polarizing plate, and liquid crystal display device | KONICA MINOLTA OPTO INC (JP) | 2008-04-09 | — | — | CN | disclosed |