⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1262446 | 0.78 | SLC22A6 (0.50) | — | |
| SCHEMBL11762978 | 0.77 | FOLH1 (0.52) | — | |
| SCHEMBL9620654 | 0.77 | GPR84 (0.45) | — | |
| SCHEMBL4284728 | 0.77 | — | — | |
| SCHEMBL6734706 | 0.75 | SLC22A6 (0.47) | — | |
| SCHEMBL7920483 | 0.75 | SLC22A6 (0.38) | — | |
| SCHEMBL1132152 | 0.75 | — | — | |
| SCHEMBL28426237 | 0.74 | ANPEP (0.50) | — | |
| SCHEMBL6466477 | 0.73 | CACNA2D1 (0.39) | — | |
| SCHEMBL11768599 | 0.73 | LMNA (0.46) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6369269-B2 | Thiol and sulfur-containing O-(meth)acrylate compounds and use thereof | MITSUI CHEMICALS, INC. (JP) | 2002-04-09 | — | — | US | disclosed |
| US-20010044555-A1 | Thiol and sulfur-containing O-(meth)acrylate counpounds and use thereof | KOBAYASHI SEIICHI (JP) | 2001-11-22 | — | — | US | disclosed |
| US-6265510-B1 | OPTICS; LENSES | MITSUI CHEMICALS, INC. (JP) | 2001-07-24 | — | — | US | disclosed |
| EP-0810210-B1 | Thiol and sulfur-containing o-(meth)acrylate compounds and use thereof | MITSUI CHEMICALS INC (JP) | 2001-01-10 | — | — | EP | disclosed |
| US-6114485-A | STARTING MATERIAL FOR A RESIN COMPOSITION USED IN OPTICAL APPLICATIONS SUCH AS A LENS | MITSUI CHEMICALS, INC. (JP) | 2000-09-05 | — | — | US | disclosed |
| US-5916987-A | OPTICAL RESIN; LENSES | MITSUI CHEMICALS, INC. (JP) | 1999-06-29 | — | — | US | disclosed |
| EP-0810210-A2 | Thiol and sulfur-containing o-(meth)acrylate compounds and use thereof | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-12-03 | — | — | EP | disclosed |