⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5453983 | 1.00 | — | — | |
| SCHEMBL8102946 | 0.98 | — | — | |
| SCHEMBL8112243 | 0.98 | — | — | |
| SCHEMBL8116961 | 0.97 | — | — | |
| SCHEMBL8118032 | 0.97 | — | — | |
| SCHEMBL8103052 | 0.95 | — | — | |
| Fumaric Acid SCHEMBL956029 | 0.95 | — | — | |
| SCHEMBL8111914 | 0.93 | GAA (0.43) | — | |
| SCHEMBL8114156 | 0.92 | ALDH1A1 (0.44) | — | |
| SCHEMBL8116524 | 0.91 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6191281-B1 | CRYSTALS OF A SALT OF (S)-(-)-2-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)-3-(3-(N-METHYL-N -(2-(3,4-METHYLENEDIOXYPHENOXY)ETHYL)AMINO)PROPYL)-1, 3-THIAZOLIDINE-4-ONE, USEFUL AS ANTIISCHEMIC AGENT | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2001-02-20 | — | — | US | claimed |
| EP-0974591-A1 | CRYSTALLINE FUMARATE OF 2-PHENYL-1,3-THIAZOLIDINE-4-ON DERIVATIVE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2000-01-26 | — | — | EP | claimed |
| US-6191281-B1 | CRYSTALS OF A SALT OF (S)-(-)-2-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)-3-(3-(N-METHYL-N -(2-(3,4-METHYLENEDIOXYPHENOXY)ETHYL)AMINO)PROPYL)-1, 3-THIAZOLIDINE-4-ONE, USEFUL AS ANTIISCHEMIC AGENT | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2001-02-20 | — | — | US | disclosed |
| EP-0974591-A1 | CRYSTALLINE FUMARATE OF 2-PHENYL-1,3-THIAZOLIDINE-4-ON DERIVATIVE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2000-01-26 | — | — | EP | disclosed |