⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3350706 | 1.00 | — | — | |
| SCHEMBL5548980 | 0.84 | ALDH1A1 (0.36) | — | |
| SCHEMBL5548982 | 0.84 | ALDH1A1 (0.36) | — | |
| SCHEMBL7612173 | 0.82 | SOAT1 (0.34) | — | |
| SCHEMBL27525255 | 0.79 | FAAH (0.31) | — | |
| SCHEMBL10595745 | 0.79 | ALDH1A1 (0.41) | — | |
| SCHEMBL1598833 | 0.79 | ALDH1A1 (0.41) | — | |
| SCHEMBL14883634 | 0.78 | — | — | |
| SCHEMBL469873 | 0.77 | — | — | |
| SCHEMBL5697682 | 0.77 | — | — |
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-20170073324-A1 | Bifidenone Compositions and Methods of Use | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2017-03-16 | — | — | US | disclosed |
| US-9562031-B1 | Phenethyldihydrobenzodioxolones and methods of use | SEQUOIA SCIENCES, INC. (US) | 2017-02-07 | — | — | US | disclosed |
| EP-0879224-A4 | NOVEL POLY(MONOPEROXYCARBONATES) | ATOCHEM NORTH AMERICA ELF (US) | 1999-05-26 | — | — | EP | disclosed |
| EP-0879224-A1 | NOVEL POLY(MONOPEROXYCARBONATES) | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1998-11-25 | — | — | EP | disclosed |
| WO-1998007684-A1 | NOVEL POLY(MONOPEROXYCARBONATES) | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1998-02-26 | — | — | WO | disclosed |
| WO-1991000301-A1 | (CO)POLYMER MODIFICATION EMPLOYING UNSATURATED t-ALKYL PEROXYALKENYL CARBONATES | AKZO N.V. (NL) | 1991-01-10 | — | — | WO | disclosed |
| US-4376731-A | 2-NITRILES THEREOF | BOEHRINGER MANNHEIM GMBH (DE) | 1983-03-15 | — | — | US | disclosed |