⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13649897 | 0.80 | MEN1 (0.31) | — | |
| SCHEMBL18330268 | 0.69 | — | — | |
| SCHEMBL880155 | 0.67 | RORC (0.33) | — | |
| SCHEMBL13196161 | 0.66 | MEN1 (0.31) | — | |
| SCHEMBL25917547 | 0.63 | HPGD (0.33) | — | |
| SCHEMBL14327672 | 0.62 | — | — | |
| SCHEMBL19034451 | 0.62 | L3MBTL1 (0.38) | — | |
| SCHEMBL12157078 | 0.61 | MAPT (0.37) | — | |
| SCHEMBL10352856 | 0.60 | MAPT (0.37) | — | |
| SCHEMBL13426475 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3166949-B1 | THIENOTHIOPHENE-ISOINDIGO | CLAP CO LTD (KR) | 2021-02-17 | — | — | EP | disclosed |