⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8215344 | 0.58 | — | — | |
| SCHEMBL27922769 | 0.57 | — | — | |
| SCHEMBL27658005 | 0.57 | — | — | |
| SCHEMBL27453811 | 0.57 | — | — | |
| SCHEMBL29167261 | 0.57 | — | — | |
| SCHEMBL5434263 | 0.57 | — | — | |
| SCHEMBL465149 | 0.57 | — | — | |
| SCHEMBL27886969 | 0.57 | — | — | |
| SCHEMBL10459703 | 0.57 | — | — | |
| SCHEMBL8409021 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113698338-A | Preparation method of styrene double oxidation product | 湖北工业大学 | 2021-11-26 | — | — | CN | claimed |
| CN-107531953-B | Composition for devulcanizing rubber crosslinked by sulfur bonds and devulcanizing method using said composition | 鲁宾泰克公司 | 2020-05-22 | — | — | CN | disclosed |
| CN-108321296-A | Trans-form low-dimensional perovskite solar cell based on photonic crystal heterojunction and preparation method thereof | 淮阴工学院 | 2018-07-24 | — | — | CN | disclosed |
| CN-108281551-A | Trans-type three-dimensional perovskite solar cell based on photonic crystal heterojunction and preparation method thereof | 淮阴工学院 | 2018-07-13 | — | — | CN | disclosed |
| US-5393461-A | For use in cosmetics, paints, drugs,inks; mixing powder with anionic, cationic, amphoteric, nonionic surfactants, oils, solvents, wetting agents and water, emulsification | RTD CORPORATION (US) | 1995-02-28 | — | — | US | disclosed |