⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL87985 | 0.79 | CA1 (0.31) | — | |
| SCHEMBL28944994 | 0.77 | ALDH1A1 (0.41) | — | |
| Methane SCHEMBL27945358 | 0.76 | ALDH1A1 (0.40) | — | |
| SCHEMBL97667 | 0.76 | LMNA (0.33) | — | |
| SCHEMBL3264113 | 0.76 | — | — | |
| SCHEMBL29080691 | 0.72 | LMNA (0.31) | — | |
| SCHEMBL8672156 | 0.68 | RCE1 (0.39) | — | |
| SCHEMBL8672157 | 0.68 | RCE1 (0.39) | — | |
| SCHEMBL10954167 | 0.68 | PDE4A (0.32) | — | |
| SCHEMBL1219983 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0686726-B1 | Paper comprising aromatic polyester fibers and process for producing the same | KURARAY CO (JP) | 2002-01-02 | — | — | EP | disclosed |
| US-5954920-A | Paper comprising aromatic polyester and process for producing the same | KURARAY CO., LTD. (JP) | 1999-09-21 | — | — | US | disclosed |
| EP-0686726-A2 | Paper comprising aromatic polyester fibers and process for producing the same | KURARAY CO., LTD. (JP) | 1995-12-13 | — | — | EP | disclosed |