⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1958323 | 1.00 | — | — | |
| Styrene SCHEMBL6325495 | 0.78 | ALDH1A1 (0.45) | — | |
| SCHEMBL28127341 | 0.78 | — | — | |
| SCHEMBL11350589 | 0.78 | — | — | |
| SCHEMBL6865342 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL11350586 | 0.78 | — | — | |
| SCHEMBL6865344 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL28615111 | 0.77 | CYP3A4 (0.41) | — | |
| SCHEMBL24728059 | 0.77 | — | — | |
| SCHEMBL26064919 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117154213-A | Viscoelastic conductive polymer electrolyte, preparation method thereof and lithium metal semi-solid battery | 四川启睿克科技有限公司 | 2023-12-01 | — | — | CN | disclosed |
| US-20200325036-A1 | HETEROGENEOUS WET SYNTHESIS PROCESS FOR PREPARATION OF HIGH PURITY TUNGSTEN PENTAHALIDE | AIR LIQUIDE (FR) | 2020-10-15 | — | — | US | disclosed |
| US-10669160-B2 | Heterogeneous wet synthesis process for preparation of high purity tungsten pentahalide | L'Air Liquide, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) | 2020-06-02 | — | — | US | disclosed |
| US-20190330076-A1 | HETEROGENEOUS WET SYNTHESIS PROCESS FOR PREPARATION OF HIGH PURITY TUNGSTEN PENTAHALIDE | L'Air Liquide, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) | 2019-10-31 | — | — | US | disclosed |
| EP-0620234-B1 | Process for preparing an aqueous dispersion pre-crosslinked with methacrylic acid anhydride | ATOCHEM ELF SA (FR) | 1998-03-18 | — | — | EP | disclosed |
| EP-0620234-A1 | Process for preparing an aqueous dispersion pre-crosslinked with methacrylic acid anhydride | ELF ATOCHEM S.A. (FR) | 1994-10-19 | — | — | EP | disclosed |
| EP-0127911-B1 | PROCESS FOR OXIDATION OF OLEFINICALLY-UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-04-10 | — | — | EP | disclosed |
| US-4721798-A | Process for epoxidation of olefinically-unsaturated compounds | SHELL OIL COMPANY (US) | 1988-01-26 | — | — | US | disclosed |
| EP-0127911-A2 | Process for oxidation of olefinically-unsaturated compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1984-12-12 | — | — | EP | disclosed |
| US-4048130-A | COPOLYMERIZATION, UNSATURATED ACIDS | LONZA LTD. (CH) | 1977-09-13 | — | — | US | disclosed |
| US-3996303-A | Organic halide | KURARAY CO., LTD. (JA) | 1976-12-07 | — | — | US | disclosed |