⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3189999 | 0.98 | HTR2A (0.31) | — | |
| SCHEMBL7800574 | 0.80 | UGT2B17 (0.30) | — | |
| SCHEMBL5612622 | 0.79 | — | — | |
| SCHEMBL7045343 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL6901531 | 0.75 | MEN1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL2590017 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL5612727 | 0.70 | — | — | |
| SCHEMBL9421537 | 0.68 | UGT2B17 (0.32) | — | |
| SCHEMBL5860056 | 0.68 | UGT2B17 (0.32) | — | |
| SCHEMBL30483498 | 0.68 | UGT2B17 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2006071-B1 | PROCESS FOR PRODUCING SHAPED ARTICLE BY T-DIE MOLDING | MITSUI CHEMICALS INC (JP) | 2012-02-22 | — | — | EP | disclosed |
| EP-2006071-A9 | PROCESS FOR PRODUCING SHAPED ARTICLE BY T-DIE MOLDING | Mitsui Chemicals, Inc. (JP) | 2009-07-22 | — | — | EP | disclosed |
| EP-2006071-A2 | PROCESS FOR PRODUCING SHAPED ARTICLE BY T-DIE MOLDING | Mitsui Chemicals, Inc. (JP) | 2008-12-24 | — | — | EP | disclosed |
| EP-1707579-A1 | EPOXIDIZED LOW-MOLECULAR-WEIGHT ETHYLENE POLYMER, MOLD-RELEASING AGENT FOR ELECTROPHOTOGRAPHIC TONER, AND ELECTROPHOTOGRAPHIC TONER FOR DEVELOPING ELECTROSTATIC IMAGE | Mitsui Chemicals, Inc. (JP) | 2006-10-04 | — | — | EP | disclosed |
| US-20060165922-A1 | Thermal transfer recording medium | MITSUI CHEMICALS, INC. (JP) | 2006-07-27 | — | — | US | disclosed |