⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2572949 | 0.77 | — | — | |
| SCHEMBL30820817 | 0.69 | — | — | |
| SCHEMBL13644355 | 0.67 | HSD17B10 (0.31) | — | |
| SCHEMBL878992 | 0.62 | EPHX2 (0.34) | — | |
| SCHEMBL29949705 | 0.62 | GBA1 (0.31) | — | |
| SCHEMBL22353336 | 0.58 | CYP19A1 (0.37) | — | |
| SCHEMBL24981741 | 0.58 | EPHX2 (0.34) | — | |
| SCHEMBL16448683 | 0.58 | APLNR (0.48) | — | |
| SCHEMBL18669866 | 0.58 | APLNR (0.48) | — | |
| SCHEMBL16448679 | 0.58 | APLNR (0.48) | — |
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-20240094519-A1 | ACETALS OF TRICYCLODECANE ALCOHOLS AS IMMERSION LIQUID MEDIA | CARL ZEISS JENA GMBH (DE) | 2024-03-21 | — | — | US | disclosed |