⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL127043 | 0.74 | GABRA1 (0.41) | — | |
| SCHEMBL29364508 | 0.74 | GABRA1 (0.41) | — | |
| Benzene SCHEMBL28107745 | 0.72 | GABRA1 (0.40) | — | |
| SCHEMBL28225610 | 0.72 | GABRA1 (0.40) | — | |
| SCHEMBL28244935 | 0.72 | GABRA1 (0.31) | — | |
| Water SCHEMBL5172983 | 0.72 | GABRA1 (0.40) | — | |
| SCHEMBL459569 | 0.72 | NPSR1 (0.37) | — | |
| SCHEMBL10950968 | 0.72 | CYP3A4 (0.38) | — | |
| SCHEMBL21623883 | 0.72 | TRPA1 (0.33) | — | |
| SCHEMBL2892800 | 0.70 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105683334-A | Photochromic composition | 株式会社德山 | 2016-06-15 | — | — | CN | disclosed |
| CN-105612220-A | Transparent plastic substrate and plastic lens | HOYA LENS THAILAND LTD | 2016-05-25 | — | — | CN | disclosed |
| EP-1637553-B1 | TRANSPARENT SHAPED BODY | HOYA CORP (JP) | 2009-11-25 | — | — | EP | disclosed |
| US-20060149018-A1 | Transparent molded article | HOYA CORPORATION (JP) | 2006-07-06 | — | — | US | disclosed |
| EP-1637553-A1 | TRANSPARENT SHAPED BODY | HOYA CORPORATION (JP) | 2006-03-22 | — | — | EP | disclosed |