⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL536794 | 0.79 | ARG1 (0.32) | — | |
| SCHEMBL1695857 | 0.78 | — | — | |
| SCHEMBL27543170 | 0.76 | — | — | |
| SCHEMBL6903472 | 0.75 | ARG1 (0.33) | — | |
| SCHEMBL6908298 | 0.73 | ARG1 (0.33) | — | |
| SCHEMBL6899828 | 0.73 | ARG1 (0.33) | — | |
| SCHEMBL9864715 | 0.73 | ARG1 (0.33) | — | |
| SCHEMBL3937904 | 0.71 | — | — | |
| SCHEMBL6469572 | 0.71 | — | — | |
| SCHEMBL9262456 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4356288-A | ALKOXIDE ANIONIC CATALYST | ROHM AND HAAS COMPANY (US) | 1982-10-26 | — | — | US | disclosed |
| US-4246370-A | ALKOXIDE ANION CATALYST IN ADDITION POLYMERIZATION PROCESS FOLLOWED BY HYDROLYSIS | ROHM AND HAAS COMPANY (US) | 1981-01-20 | — | — | US | disclosed |
| US-4158736-A | ANIONIC POLYMERIZATION | ROHM AND HAAS COMPANY (US) | 1979-06-19 | — | — | US | disclosed |