⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1460813 | 1.00 | — | — | |
| SCHEMBL1460812 | 1.00 | — | — | |
| SCHEMBL2245103 | 0.97 | LMNA (0.41) | — | |
| SCHEMBL2538890 | 0.97 | LMNA (0.41) | — | |
| SCHEMBL2542576 | 0.97 | — | — | |
| SCHEMBL1721189 | 0.91 | — | — | |
| SCHEMBL21104456 | 0.91 | — | — | |
| SCHEMBL30110429 | 0.84 | LMNA (0.37) | — | |
| SCHEMBL2249178 | 0.79 | MEN1 (0.42) | — | |
| SCHEMBL9455987 | 0.78 | SMN1; SMN2 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-8217710-A | — | — | None | — | — | JP | disclosed |
| JP-H08217710-A | OPTICALLY ACTIVE 5-FLUORO-1-ALKANOL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL ELEMENT CONTAINING THE SAME | CANON INC | 1996-08-27 | — | — | JP | disclosed |