⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8639456 | 0.89 | — | — | |
| SCHEMBL8640947 | 0.86 | ALOX15 (0.32) | — | |
| SCHEMBL4925399 | 0.78 | — | — | |
| SCHEMBL5889823 | 0.77 | — | — | |
| SCHEMBL942320 | 0.76 | THRB (0.31) | — | |
| SCHEMBL5889516 | 0.76 | ALDH1A1 (0.39) | — | |
| SCHEMBL8639457 | 0.75 | ALOX15 (0.34) | — | |
| SCHEMBL10799219 | 0.75 | THRB (0.31) | — | |
| SCHEMBL11360327 | 0.74 | — | — | |
| SCHEMBL2368022 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5851422-A | Polymeric material for liquid crystal/polymer composite film, record display medium, and use thereof | DAI NIPPON PRINTING CO., LTD. (JP) | 1998-12-22 | — | — | US | disclosed |
| EP-0790289-A1 | Polymeric material for liquid crystal/polymer composite film, liquid crystal/polymer composite film, record display medium, and use thereof | DAI NIPPON PRINTING CO., LTD. (JP) | 1997-08-20 | — | — | EP | disclosed |