⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20143617 | 0.84 | — | — | |
| SCHEMBL19847471 | 0.82 | — | — | |
| SCHEMBL24996572 | 0.75 | NOS3 (0.33) | — | |
| SCHEMBL19021593 | 0.73 | — | — | |
| SCHEMBL25991145 | 0.72 | — | — | |
| SCHEMBL20628325 | 0.72 | — | — | |
| SCHEMBL21646819 | 0.67 | ALDH1A1 (0.38) | — | |
| SCHEMBL25059867 | 0.65 | CA1 (0.30) | — | |
| SCHEMBL21891838 | 0.64 | CTSL (0.32) | — | |
| SCHEMBL12834846 | 0.64 | EPHX2 (0.38) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10759895-B2 | Polymerizable composition for optical material | SKC CO., LTD. (KR) | 2020-09-01 | — | — | US | disclosed |
| US-20200224068-A1 | OPTICALLY CLEAR ADHESIVE SHEET, METHOD FOR MANUFACTURING OPTICALLY CLEAR ADHESIVE SHEET, LAMINATE, AND BONDED STRUCTURE | BANDO CHEMICAL INDUSTRIES, LTD. (JP) | 2020-07-16 | — | — | US | disclosed |
| US-20190202968-A1 | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL | SK PUCORE CO., LTD. (KR) | 2019-07-04 | — | — | US | disclosed |