⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10495501 | 0.87 | — | — | |
| SCHEMBL18167380 | 0.82 | — | — | |
| SCHEMBL2343 | 0.82 | — | — | |
| SCHEMBL2002087 | 0.82 | — | — | |
| SCHEMBL10597074 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL1687370 | 0.67 | — | — | |
| Lithium Ion SCHEMBL329773 | 0.67 | — | — | |
| Water SCHEMBL10886625 | 0.67 | — | — | |
| SCHEMBL2390296 | 0.67 | — | — | |
| SCHEMBL1313003 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4876392-A | Process for preparation of keystones by oxidation of secondary alcohols using a trimetallic catalyst comprising molybdenum, rhenium and a group VIII noble metal | EXXON RESEARCH & ENGINEERING COMPANY (US) | 1989-10-24 | — | — | US | disclosed |
| EP-0105663-B1 | CATALYSTS AND PROCESS FOR OXIDATION OF OLEFINS TO KETONES | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1988-06-22 | — | — | EP | disclosed |
| US-4737482-A | RHENIUM, GROUPS 6B AND SB NOBLE METAL SULFIDES ON SUPPORT | EXXON RESEARCH & ENGINEERING CO. (US) | 1988-04-12 | — | — | US | disclosed |
| US-4560803-A | HIGH SELECTIVITY, BY-PRODUCT INHIBITION; RHENIUM GROUP VIB AND GROUP VIII OXIDES AND SULFIDES | EXXON RESEARCH & ENGINEERING CO. (US) | 1985-12-24 | — | — | US | disclosed |
| EP-0105663-A2 | Catalysts and process for oxidation of olefins to ketones | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1984-04-18 | — | — | EP | disclosed |