⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6893783 | 0.77 | — | — | |
| SCHEMBL4357181 | 0.76 | — | — | |
| SCHEMBL2567606 | 0.76 | — | — | |
| SCHEMBL28881116 | 0.76 | — | — | |
| SCHEMBL2563930 | 0.72 | LCK (0.32) | — | |
| SCHEMBL30678313 | 0.72 | LCK (0.32) | — | |
| SCHEMBL2566428 | 0.72 | LCK (0.32) | — | |
| SCHEMBL2564957 | 0.67 | — | — | |
| SCHEMBL2565782 | 0.66 | — | — | |
| SCHEMBL2561779 | 0.64 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6005012-A | DEHALOGENATION OF ORGANOMETALLIC HALIDES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1999-12-21 | — | — | US | claimed |
| US-5958363-A | Method for making monolithic metal oxide aerogels | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1999-09-28 | — | — | US | claimed |
| US-11512002-B2 | Silica materials and methods of making thereof | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2022-11-29 | — | — | US | disclosed |
| US-20190322535-A1 | Silica Materials and Methods of Making Thereof | UNIVERSITY OF VIRGINIA PATENT FOUNDATION | 2019-10-24 | — | — | US | disclosed |
| EP-1098926-B1 | CROSS-LINKABLE HYPERBRANCHED POLYMERS, METHOD FOR THE PRODUCTION AND USE OF THE SAME | BAYER MATERIALSCIENCE AG (DE) | 2004-03-03 | — | — | EP | disclosed |
| EP-1098926-A1 | CROSS-LINKABLE HYPERBRANCHED POLYMERS, METHOD FOR THE PRODUCTION AND USE OF THE SAME | Bayer Aktiengesellschaft (DE) | 2001-05-16 | — | — | EP | disclosed |
| WO-2000002954-A1 | CROSS-LINKABLE HYPERBRANCHED POLYMERS, METHOD FOR THE PRODUCTION AND USE OF THE SAME | BAYER AKTIENGESELLSCHAFT (DE) | 2000-01-20 | — | — | WO | disclosed |
| US-6005012-A | DEHALOGENATION OF ORGANOMETALLIC HALIDES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1999-12-21 | — | — | US | disclosed |
| US-5958363-A | Method for making monolithic metal oxide aerogels | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1999-09-28 | — | — | US | disclosed |