⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17965809 | 0.97 | ALDH1A1 (0.35) | — | |
| SCHEMBL17965839 | 0.97 | ALDH1A1 (0.35) | — | |
| SCHEMBL17965717 | 0.97 | ALDH1A1 (0.35) | — | |
| SCHEMBL17965733 | 0.97 | ALDH1A1 (0.35) | — | |
| SCHEMBL17965702 | 0.97 | — | — | |
| SCHEMBL17965703 | 0.97 | ALDH1A1 (0.35) | — | |
| SCHEMBL10980299 | 0.91 | — | — | |
| SCHEMBL10945268 | 0.81 | ALDH1A1 (0.41) | — | |
| SCHEMBL11674706 | 0.78 | ALDH1A1 (0.42) | — | |
| SCHEMBL20597518 | 0.78 | ALDH1A1 (0.42) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105859529-B | Method for producing asymmetric conjugated diyne compound and method for producing Z, Z-conjugated diene compound using the same | 信越化学工业株式会社 | 2020-10-16 | — | — | CN | disclosed |
| EP-3053906-B1 | METHOD FOR PRODUCING ASYMMETRIC CONJUGATED DIYNE COMPOUND AND METHOD FOR PRODUCING Z,Z-CONJUGATED DIENE COMPOUND USING THE SAME | SHINETSU CHEMICAL CO (JP) | 2017-12-27 | — | — | EP | disclosed |
| US-9845304-B2 | Method for producing asymmetric conjugated diyne compound and method for producing Z,Z-conjugated diene compound using the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2017-12-19 | — | — | US | disclosed |
| US-20160229829-A1 | Method for Producing Asymmetric Conjugated Diyne Compound and Method for Producing Z,Z-Conjugated Diene Compound Using the Same | SHIN-ETSU CHEMICAL CO., LTD (JP) | 2016-08-11 | — | — | US | disclosed |
| EP-3053906-A1 | METHOD FOR PRODUCING ASYMMETRIC CONJUGATED DIYNE COMPOUND AND METHOD FOR PRODUCING Z,Z-CONJUGATED DIENE COMPOUND USING THE SAME | Shin-Etsu Chemical Co., Ltd. (JP) | 2016-08-10 | — | — | EP | disclosed |
| CN-1113886-C | Chemisorptive substance, aligned liquid-crystal film and liquid-crystal display element both made by using the same, and processes for producing these | MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) | 2003-07-09 | — | — | CN | disclosed |
| US-20030104145-A1 | Chemical adsorbent and liquid crystal alignment layer utilizing the same and liquid crystal display device utilizing the same and methods of manufacturing them | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 2003-06-05 | — | — | US | disclosed |
| US-6495221-B1 | EXTREMELY THIN AND TRANSPARENT FILM IN NANOMETER ORDER; HYDROCHALCONE DERIVATIVE SUBSTITUTED WITH A ISOCYANATOSILYL GROUP | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 2002-12-17 | — | — | US | disclosed |
| EP-0962460-A1 | CHEMISORPTIVE SUBSTANCE, ALIGNED LIQUID-CRYSTAL FILM AND LIQUID-CRYSTAL DISPLAY ELEMENT BOTH MADE BY USING THE SAME, AND PROCESSES FOR PRODUCING THESE | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 1999-12-08 | — | — | EP | disclosed |
| CN-1236368-A | Chemisorptive substance, aligned liquid-crystal film and liquid-crystal display element both made by using the same, and processes for producing these | MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) | 1999-11-24 | — | — | CN | disclosed |
| EP-0042069-B1 | METAL SALTS OF POLYACETYLENIC COMPOUNDS AND USES THEREOF | ALLIED CORPORATION (US) | 1985-02-06 | — | — | EP | disclosed |
| EP-0036899-B1 | THERMOCHROMIC POLYACETYLENIC COMPOSITION, PROCESS THEREFOR, TEMPERATURE MEASURING AND INDICIA DISPLAYING DEVICES AND PROCESS FOR RECORDING AND THEREAFTER ERASING IMAGES | ALLIED CORPORATION (US) | 1984-08-01 | — | — | EP | disclosed |
| US-4339951-A | Tempeature measurement and display of indicia using thermochromic polyacetylenes | ALLIED CORPORATION (US) | 1982-07-20 | — | — | US | disclosed |
| EP-0042069-A2 | Metal salts of polyacetylenic compounds and uses thereof | ALLIED CORPORATION (US) | 1981-12-23 | — | — | EP | disclosed |
| EP-0036899-A1 | Thermochromic polyacetylenic composition, process therefor, temperature measuring and indicia displaying devices and process for recording and thereafter erasing images | ALLIED CORPORATION (US) | 1981-10-07 | — | — | EP | disclosed |
| US-4242440-A | Thermochromic polyacetylenes used in laser beam recording method | ALLIED CHEMICAL CORPORATION (US) | 1980-12-30 | — | — | US | disclosed |
| US-4215208-A | Thermochromic polyacetylenes containing urethane groups | ALLIED CHEMICAL CORPORATION (US) | 1980-07-29 | — | — | US | disclosed |
| US-4208501-A | PHOTOCONDUCTORS AND OPTICAL DEVICES | ALLIED CHEMICAL CORPORATION (US) | 1980-06-17 | — | — | US | disclosed |
| US-4125534-A | HIGH ENERGY RADIATION DOSAGE INDICATORS | ALLIED CHEMICAL CORPORATION (US) | 1978-11-14 | — | — | US | disclosed |