⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11035756 | 0.92 | — | — | |
| SCHEMBL9794925 | 0.83 | NOS3 (0.31) | — | |
| SCHEMBL67012 | 0.83 | — | — | |
| SCHEMBL13721433 | 0.78 | — | — | |
| SCHEMBL8853228 | 0.78 | TSHR (0.44) | — | |
| SCHEMBL11329197 | 0.76 | — | — | |
| SCHEMBL12537679 | 0.75 | — | — | |
| SCHEMBL690137 | 0.69 | — | — | |
| Maleic Acid SCHEMBL9500750 | 0.68 | ALDH1A1 (0.38) | — | |
| SCHEMBL10604642 | 0.68 | TSHR (0.48) | — |
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-3196016-B1 | LAMINATE FILM AND PACKAGING BAG USING SAME | MITSUI CHEMICALS INC (JP) | 2020-01-29 | — | — | EP | disclosed |
| EP-3196016-A1 | LAMINATE FILM AND PACKAGING BAG USING SAME | Mitsui Chemicals, Inc. (JP) | 2017-07-26 | — | — | EP | disclosed |
| US-20100093904-A1 | GRANULAR STABILIZER FOR POLYMER AND PRODUCTION PROCESS THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-04-15 | — | — | US | disclosed |
| US-5037891-A | Heating and kneading with free-radical initiator, vinyl aromatic monomer, unsaturated dicarboxylic anhydride | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1991-08-06 | — | — | US | disclosed |
| US-4438243-A | Process for producing random ethylene terpolymer | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1984-03-20 | — | — | US | disclosed |