⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4586844 | 1.00 | — | — | |
| SCHEMBL4586058 | 0.96 | IDO1 (0.30) | — | |
| SCHEMBL4572706 | 0.81 | IDO1 (0.32) | — | |
| SCHEMBL17859400 | 0.78 | ELANE (0.32) | — | |
| SCHEMBL5010702 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL5011009 | 0.75 | — | — | |
| SCHEMBL12403126 | 0.74 | — | — | |
| SCHEMBL8993480 | 0.73 | IDO1 (0.35) | — | |
| SCHEMBL5010157 | 0.72 | LMNA (0.46) | — | |
| SCHEMBL9628628 | 0.71 | TSHR (0.33) | — |
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-2471796-B1 | NOVEL ADDUCT COMPOUND, SOLUTION FOR FORMATION OF ORGANIC SEMICONDUCTOR FILM, METHOD FOR PRODUCING SAID SEMICONDUCTOR FILM AND METHOD FOR SYNTHESIZING SAID ADDUCT COMPOUND | TEIJIN LTD (JP) | 2019-10-30 | — | — | EP | disclosed |
| EP-2793280-B1 | ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | NIPPON STEEL & SUMIKIN CHEM CO (JP) | 2017-03-29 | — | — | EP | disclosed |
| US-8829202-B2 | Condensed polycyclic aromatic compound, aromatic polymer, and method for synthesizing aromatic compound | TEIJIN LIMITED (JP) | 2014-09-09 | — | — | US | disclosed |
| US-20140187792-A1 | CONDENSED POLYCYCLIC AROMATIC COMPOUND, AROMATIC POLYMER, AND METHOD FOR SYNTHESIZING AROMATIC COMPOUND | TEIJIN LIMITED (JP) | 2014-07-03 | — | — | US | disclosed |
| EP-2740735-A1 | CONDENSED POLYCYCLIC AROMATIC COMPOUND, AROMATIC POLYMER, AND METHOD FOR SYNTHESIZING AROMATIC COMPOUND | Teijin Limited (JP) | 2014-06-11 | — | — | EP | disclosed |
| US-7319153-B2 | 6,13-Bis(thienyl)pentacene compounds | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2008-01-15 | — | — | US | disclosed |
| WO-2007016115-A2 | 6,13-BIS(THIENYL)PENTACENE COMPOUNDS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2007-02-08 | — | — | WO | disclosed |
| US-20070023748-A1 | 6,13-Bis(thienyl)pentacene compounds | 3M INNOVATIVE PROPERTIES COMPANY | 2007-02-01 | — | — | US | disclosed |