⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL771887 | 0.87 | — | — | |
| SCHEMBL16605146 | 0.78 | — | — | |
| SCHEMBL16623404 | 0.78 | — | — | |
| SCHEMBL19704631 | 0.75 | — | — | |
| SCHEMBL19718303 | 0.73 | NPC1 (0.33) | — | |
| SCHEMBL28382727 | 0.73 | GSK3B (0.33) | — | |
| SCHEMBL7791817 | 0.71 | NR1D1 (0.33) | — | |
| SCHEMBL21936666 | 0.71 | PIK3R1 (0.33) | — | |
| SCHEMBL793199 | 0.65 | CES1 (0.30) | — | |
| SCHEMBL31434443 | 0.63 | FBP1 (0.34) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017191468-A1 | NON-FULLERENE ELECTRON ACCEPTORS | IMPERIAL INNOVATIONS LIMITED (GB) | 2017-11-09 | — | — | WO | disclosed |
| WO-2017191466-A1 | ORGANIC TERNARY BLENDS | IMPERIAL INNOVATIONS LIMITED (GB) | 2017-11-09 | — | — | WO | disclosed |
| US-20160372680-A1 | HETEROCYCLIC COMPOUND AND ORGANIC SOLAR CELL COMPRISING THE SAME | LG CHEM, LTD. (KR) | 2016-12-22 | — | — | US | disclosed |
| US-20160372680-A1 | HETEROCYCLIC COMPOUND AND ORGANIC SOLAR CELL COMPRISING THE SAME | LG CHEM, LTD. (KR) | 2016-12-22 | — | — | US | disclosed |
| US-8709290-B2 | Polymers derived from benzobis(silolothiophene) and their use as organic semiconductors | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2014-04-29 | — | — | US | disclosed |
| EP-2459614-B1 | POLYMERS DERIVED FROM BENZOBIS(SILOLOTHIOPHENE) AND THEIR USE AS ORGANIC SEMICONDUCTORS | MERCK PATENT GMBH (DE) | 2013-06-12 | — | — | EP | disclosed |
| EP-2459614-B1 | POLYMERS DERIVED FROM BENZOBIS(SILOLOTHIOPHENE) AND THEIR USE AS ORGANIC SEMICONDUCTORS | MERCK PATENT GMBH (DE) | 2013-06-12 | — | — | EP | disclosed |
| EP-2459614-A1 | POLYMERS DERIVED FROM BENZOBIS(SILOLOTHIOPHENE) AND THEIR USE AS ORGANIC SEMICONDUCTORS | Merck Patent GmbH (DE) | 2012-06-06 | — | — | EP | disclosed |
| US-20110168953-A1 | Polymers Derived from Benzobis(silolothiophene) and their Use as Organic Semiconductors | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2011-07-14 | — | — | US | disclosed |
| US-20110168953-A1 | Polymers Derived from Benzobis(silolothiophene) and their Use as Organic Semiconductors | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2011-07-14 | — | — | US | disclosed |
| WO-2010031480-A1 | POLYMERS DERIVED FROM BENZOBIS(SILOLOTHIOPHENE) AND THEIR USE AS ORGANIC SEMICONDUCTORS | MERCK PATENT GMBH (DE) | 2010-03-25 | — | — | WO | disclosed |