⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28587613 | 0.85 | — | — | |
| SCHEMBL8660407 | 0.80 | — | — | |
| SCHEMBL124489 | 0.76 | CA2 (0.30) | — | |
| SCHEMBL701600 | 0.73 | THRB (0.32) | — | |
| SCHEMBL562520 | 0.73 | — | — | |
| SCHEMBL1790074 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL1790076 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL88862 | 0.72 | — | — | |
| SCHEMBL5681332 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL563495 | 0.70 | THRB (0.39) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2411429-B1 | ELASTOMERIC COMPOSITIONS COMPRISING FLUORINATED ADDITIVES AND USE THEREOF FOR THE MANUFACTURE OF DRIVE BELTS | DAYCO EUROPE SRL (IT) | 2013-03-06 | — | — | EP | claimed |
| US-5863298-A | USING PRESSURIZED CARBON DIOXIDE WITH FLUORINATED HYDROCARBON IN CONTACT WITH YARN | BATTELLE MEMORIAL INSTITUTE (US) | 1999-01-26 | — | — | US | claimed |
| WO-1997033033-A1 | METHOD FOR SIZING AND DESIZING YARNS WITH LIQUID AND SUPERCRITICAL CARBON DIOXIDE SOLVENT | BATTELLE MEMORIAL INSTITUTE (US) | 1997-09-12 | — | — | WO | claimed |
| US-9640799-B2 | Negative electrode active material for non-lithium secondary battery, method of preparing the same, negative electrode for non-lithium secondary battery including the same, and non-lithium secondary battery including the negative electrode | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2017-05-02 | — | — | US | disclosed |
| US-20150333326-A1 | NEGATIVE ELECTRODE ACTIVE MATERIAL FOR NON-LITHIUM SECONDARY BATTERY, METHOD OF PREPARING THE SAME, NEGATIVE ELECTRODE FOR NON-LITHIUM SECONDARY BATTERY INCLUDING THE SAME, AND NON-LITHIUM SECONDARY BATTERY INCLUDING THE NEGATIVE ELECTRODE | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2015-11-19 | — | — | US | disclosed |
| US-5863298-A | USING PRESSURIZED CARBON DIOXIDE WITH FLUORINATED HYDROCARBON IN CONTACT WITH YARN | BATTELLE MEMORIAL INSTITUTE (US) | 1999-01-26 | — | — | US | disclosed |
| WO-1997033033-A1 | METHOD FOR SIZING AND DESIZING YARNS WITH LIQUID AND SUPERCRITICAL CARBON DIOXIDE SOLVENT | BATTELLE MEMORIAL INSTITUTE (US) | 1997-09-12 | — | — | WO | disclosed |
| US-5639464-A | Biocidal polymeric coating for heat exchanger coils | INTERFACE, INC. (US) | 1997-06-17 | — | — | US | disclosed |