⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5555288 | 1.00 | — | — | |
| Cysteine SCHEMBL9780171 | 0.79 | PTGS1 (0.94) | — | |
| Cysteine SCHEMBL9780174 | 0.79 | PTGS1 (0.94) | — | |
| Cysteine SCHEMBL4864416 | 0.77 | PTGS1 (0.55) | — | |
| Cysteine SCHEMBL28081717 | 0.77 | PTGS1 (0.89) | — | |
| Cysteine SCHEMBL28081716 | 0.77 | PTGS1 (0.89) | — | |
| Cysteine SCHEMBL4864408 | 0.77 | PTGS1 (0.55) | — | |
| Cysteine SCHEMBL95110 | 0.75 | — | — | |
| Cysteine SCHEMBL4289403 | 0.75 | — | — | |
| SCHEMBL16033448 | 0.75 | — | — |
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-1296380-C | Pharmaceutical compounds | NICOX SA (FR) | 2007-01-24 | — | — | CN | disclosed |
| US-5698585-A | FOR SENILE CATARACT CAUSED BY OXIDATION DISORDER; VISION DEFECTS | KIKKOMAN CORPORATION (JP) | 1997-12-16 | — | — | US | disclosed |
| EP-0737476-A2 | A pharmaceutical preparation containing a 3-(2H)-furanone derivative for prevention and/or treatment of cataracts | KIKKOMAN CORPORATION (JP) | 1996-10-16 | — | — | EP | disclosed |
| US-4914206-A | ANTIBIOTICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-04-03 | — | — | US | disclosed |
| EP-0226896-A2 | Lankacidin derivatives and production thereof | Takeda Chemical Industries, Ltd. (JP) | 1987-07-01 | — | — | EP | disclosed |