⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15440623 | 0.72 | GRM4 (0.37) | — | |
| SCHEMBL9011285 | 0.72 | G6PD (0.30) | — | |
| SCHEMBL76019 | 0.72 | GRM4 (0.37) | — | |
| SCHEMBL30436730 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL28770911 | 0.71 | GRM4 (0.36) | — | |
| SCHEMBL10277256 | 0.71 | GRM4 (0.36) | — | |
| Hydrochloric Acid SCHEMBL4196175 | 0.71 | GRM4 (0.36) | — | |
| Hydrochloric Acid SCHEMBL3688896 | 0.71 | GRM4 (0.36) | — | |
| SCHEMBL30199518 | 0.71 | GRM4 (0.36) | — | |
| SCHEMBL27603732 | 0.71 | EPHX1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1279692-B1 | OPTICAL PARTS AND SULFUR-CONTAINING POLY(THIO)ESTER (CO)POLYMER | MITSUI CHEMICALS INC (JP) | 2009-02-18 | — | — | EP | disclosed |
| US-7008571-B2 | Optical component and sulfur-containing poly(thio)ester (co)polymer | MITSUI CHEMICALS, INC. (JP) | 2006-03-07 | — | — | US | disclosed |
| US-20030204030-A1 | Optical parts and sulfur-containing poly (thio)ester (co)polymer | MITSUI CHEMICALS, INC. (JP) | 2003-10-30 | — | — | US | disclosed |
| EP-1279692-A1 | OPTICAL PARTS AND SULFUR-CONTAINING POLY(THIO)ESTER (CO)POLYMER | Mitsui Chemicals, Inc. (JP) | 2003-01-29 | — | — | EP | disclosed |