⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27623512 | 0.81 | MEN1 (0.35) | — | |
| SCHEMBL27568862 | 0.78 | TRPA1 (0.41) | — | |
| SCHEMBL27518131 | 0.78 | TSHR (0.39) | — | |
| SCHEMBL27695236 | 0.78 | ALDH1A1 (0.44) | — | |
| SCHEMBL27587618 | 0.78 | FAAH (0.31) | — | |
| SCHEMBL2987795 | 0.75 | EPHX2 (0.33) | — | |
| SCHEMBL28775275 | 0.75 | PRKCA (0.41) | — | |
| SCHEMBL2986793 | 0.75 | EPHX2 (0.33) | — | |
| SCHEMBL28714347 | 0.75 | EPHX2 (0.33) | — | |
| SCHEMBL28140349 | 0.74 | TSHR (0.33) | — |
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-101253229-B | Cellulose ester film, polarizer and display device | KONICA MINOLTA OPTO INC | 2012-07-04 | — | — | CN | disclosed |
| CN-101253229-A | Cellulose ester film, polarizer and display device | KONICA MINOLTA OPTO INC (JP) | 2008-08-27 | — | — | CN | disclosed |