⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5889395 | 0.80 | — | — | |
| SCHEMBL6830021 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL432665 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL15101930 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL432664 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL28984749 | 0.74 | — | — | |
| SCHEMBL11048888 | 0.74 | — | — | |
| SCHEMBL29121078 | 0.73 | — | — | |
| SCHEMBL306388 | 0.73 | — | — | |
| SCHEMBL6056076 | 0.73 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101754999-A | monodisperse particles | UNILEVER PLC | 2010-06-23 | — | — | CN | claimed |
| CN-111740108-B | High-nickel ternary cathode water-based binder for lithium ion battery and preparation method thereof | 浙江中科立德新材料有限公司 | 2022-06-28 | — | — | CN | disclosed |
| CN-113130773-B | Quantum dot light-emitting diode and preparation method thereof | TCL科技集团股份有限公司 | 2022-06-24 | — | — | CN | disclosed |
| CN-113130773-A | Quantum dot light-emitting diode and preparation method thereof | TCL集团股份有限公司 | 2021-07-16 | — | — | CN | disclosed |
| CN-111740108-A | High-nickel ternary cathode aqueous binder for lithium ion battery and preparation method thereof | 浙江中科立德新材料有限公司 | 2020-10-02 | — | — | CN | disclosed |
| CN-103180783-B | Method for making high resolution, solvent resistant, elastomeric thin printing plates | E.I.内穆尔杜邦公司 | 2016-06-22 | — | — | CN | disclosed |
| CN-103987776-A | Tyre provided with an outer sidewall comprising a mixture of a diene elastomer and a thermoplastic elastomer | MICHELIN & CIE | 2014-08-13 | — | — | CN | disclosed |
| CN-103975012-A | Tire provided with a tread made from a mixture of a diene elastomer and a thermoplastic elastomer | MICHELIN RECH TECH | 2014-08-06 | — | — | CN | disclosed |
| CN-103958589-A | Tyre provided with inner layer comprising mixture of diene elastomer and thermoplastic elastomer | MICHELIN & CIE | 2014-07-30 | — | — | CN | disclosed |
| CN-102939210-A | Inflatable article having an airtight layer comprising a thermoplastic elastomer and a thermoplastic | MICHELIN SOC TECH | 2013-02-20 | — | — | CN | disclosed |
| CN-101754999-A | monodisperse particles | UNILEVER PLC | 2010-06-23 | — | — | CN | disclosed |
| US-6787621-B2 | USING DIARYLETHENE MONOMERS FOR MAKING PHOTOCHROMIC POLYMERIZABLE THIN FILM | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2004-09-07 | — | — | US | disclosed |
| US-20030130456-A1 | Vinyl group-containing diarylethene and polymer thereof having excellent optical properties | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY | 2003-07-10 | — | — | US | disclosed |