⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9337261 | 0.89 | — | — | |
| SCHEMBL85 | 0.87 | — | — | |
| SCHEMBL1785790 | 0.87 | — | — | |
| Phosphine SCHEMBL11513801 | 0.75 | — | — | |
| Water SCHEMBL10417157 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL852872 | 0.75 | — | — | |
| SCHEMBL11372963 | 0.75 | — | — | |
| SCHEMBL7448413 | 0.75 | — | — | |
| SCHEMBL3045261 | 0.75 | — | — | |
| SCHEMBL5601209 | 0.75 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8455706-B2 | Method of making linear alkylbenzenes | H R D CORPORATION (US) | 2013-06-04 | — | — | US | disclosed |
| US-20120296144-A1 | METHOD OF MAKING LINEAR ALKYLBENZENES | H R D CORPORATION | 2012-11-22 | — | — | US | disclosed |
| EP-2158173-A2 | METHOD OF MAKING LINEAR ALKYLBENZENES | H R D Corporation (US) | 2010-03-03 | — | — | EP | disclosed |
| US-20090005622-A1 | METHOD OF MAKING LINEAR ALKYLBENZENES | H R D CORPORATION (US) | 2009-01-01 | — | — | US | disclosed |
| WO-2009003051-A2 | METHOD OF MAKING LINEAR ALKYLBENZENES | H R D CORPORATION (US) | 2008-12-31 | — | — | WO | disclosed |
| WO-1996016071-A1 | PROCESSES FOR THE SYNTHESIS OF 3'-SUBSTITUTED LEWISx COMPOUNDS | GLYCOMED, INC. (US) | 1996-05-30 | — | — | WO | disclosed |
| US-3998974-A | Comestibles containing non-nutritive flavoring | DYNAPOL CORPORATION (US) | 1976-12-21 | — | — | US | disclosed |