⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27740885 | 0.75 | — | — | |
| SCHEMBL3332190 | 0.73 | — | — | |
| Methacrylic Acid SCHEMBL2401419 | 0.73 | TET2 (0.39) | — | |
| SCHEMBL22028092 | 0.72 | — | — | |
| SCHEMBL5350646 | 0.72 | OR51E2 (0.32) | — | |
| Acetic Acid SCHEMBL28204352 | 0.71 | TDP1 (0.48) | — | |
| SCHEMBL11303419 | 0.71 | — | — | |
| SCHEMBL28595955 | 0.71 | — | — | |
| SCHEMBL279658 | 0.71 | — | — | |
| SCHEMBL11124092 | 0.71 | TDP1 (0.40) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991018861-A1 | 2-(HYDROXYMETHYL) ACRYLATE DERIVATIVES AND PROCESS FOR THEIR PREPARATION | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 1991-12-12 | — | — | WO | claimed |
| US-9969767-B2 | Oxolupene derivatives | VIIV Healthcare UK (No.5) Limited (GB) | 2018-05-15 | — | — | US | disclosed |
| US-20170340650-A1 | TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY | 2017-11-30 | — | — | US | disclosed |
| US-20170334946-A1 | OXOLUPENE DERIVATIVES | BRISTOL-MYERS SQUIBB COMPANY | 2017-11-23 | — | — | US | disclosed |
| US-9527882-B2 | Triterpenoids with HIV maturation inhibitory activity | ViiV Healthcare UK (No.4) Limited (GB) | 2016-12-27 | — | — | US | disclosed |
| US-20150291655-A1 | TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY | VIIV HEALTHCARE UK (NO. 4) LIMITED (GB) | 2015-10-15 | — | — | US | disclosed |
| US-8993766-B2 | Method of preparing tetrabenazine and dihydrotetrabenazine | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2015-03-31 | — | — | US | disclosed |
| US-20130197227-A1 | METHOD OF PREPARING TETRABENAZINE AND DIHYDROTETRABENAZINE | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2013-08-01 | — | — | US | disclosed |
| US-7465726-B2 | Substituted pyrrolo[2.3-B]pyridines | OSI PHARMACEUTICALS, INC. (US) | 2008-12-16 | — | — | US | disclosed |
| US-7393812-B2 | Methylidene mevalonates and their use as herbicides | DOW AGROSCIENCES LLC (US) | 2008-07-01 | — | — | US | disclosed |
| US-7393812-B2 | Methylidene mevalonates and their use as herbicides | DOW AGROSCIENCES LLC (US) | 2008-07-01 | — | — | US | disclosed |
| US-7393812-B2 | Methylidene mevalonates and their use as herbicides | DOW AGROSCIENCES LLC (US) | 2008-07-01 | — | — | US | disclosed |
| US-20060111241-A1 | Methylidene mevalonates and their use as herbicides | CORTEVA AGRISCIENCE LLC | 2006-05-25 | — | — | US | disclosed |