⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL792741 | 0.78 | — | — | |
| SCHEMBL3126068 | 0.69 | — | — | |
| SCHEMBL28909422 | 0.69 | — | — | |
| SCHEMBL9297285 | 0.69 | — | — | |
| SCHEMBL18342507 | 0.69 | — | — | |
| SCHEMBL1260780 | 0.69 | — | — | |
| SCHEMBL4773821 | 0.67 | — | — | |
| SCHEMBL23546 | 0.66 | — | — | |
| SCHEMBL10897274 | 0.65 | — | — | |
| SCHEMBL273366 | 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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115745836-A | Method for inducing reaction of alkyl neopentyl benzene and capture reagent by photocatalyst | 深圳湾实验室坪山生物医药研发转化中心 | 2023-03-07 | — | — | CN | disclosed |
| US-20090312559-A1 | CATALYTIC ENANTIOSELECTIVE SILYLATIONS OF SUBSTRATES | NATIONAL INSTITUTES OF HEALTH, U.S. DEPARTMENT OF HEALTH AND HUMAN SERVICES, U.S. GOVERNMENT | 2009-12-17 | — | — | US | disclosed |
| WO-2007082026-A2 | CATALYTIC ENANTIOSELECTIVE SILYLATIONS OF SUBSTRATES | THE TRUSTEES OF BOSTON COLLEGE (US) | 2007-07-19 | — | — | WO | disclosed |
| CN-1176960-C | Viscosity increaser and preparing process thereof | 埃克森美孚化学专利公司 | 2004-11-24 | — | — | CN | disclosed |
| CN-1427015-A | Viscosity increaser and preparing process thereof | EXXON MOBIL CHEM PATENTS INC (US) | 2003-07-02 | — | — | CN | disclosed |
| CN-1203605-A | tackifier and preparation method thereof | EXXON CHEMICAL PATENTS INC (US) | 1998-12-30 | — | — | CN | disclosed |
| US-4260842-A | Isomerization of olefins utilizing heterogeneous dioxyzirconium catalysts | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 1981-04-07 | — | — | US | disclosed |