⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL315166 | 0.83 | — | — | |
| Ethylene SCHEMBL28228274 | 0.80 | — | — | |
| SCHEMBL28861374 | 0.75 | — | — | |
| SCHEMBL25187089 | 0.75 | — | — | |
| SCHEMBL25173698 | 0.73 | — | — | |
| SCHEMBL25179792 | 0.69 | — | — | |
| SCHEMBL25183119 | 0.69 | — | — | |
| SCHEMBL14327994 | 0.67 | — | — | |
| SCHEMBL25179723 | 0.67 | — | — | |
| SCHEMBL432980 | 0.67 | ALDH1A1 (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230250287-A1 | TWO-COMPONENT TYPE ROOM TEMPERATURE FAST-CURING ORGANOPOLYSILOXANE COMPOSITION, CURED PRODUCT THEREOF AND ARTICLE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-08-10 | — | — | US | disclosed |
| EP-4180488-A1 | TWO-COMPONENT TYPE ROOM TEMPERATURE FAST-CURING ORGANOPOLYSILOXANE COMPOSITION, CURED PRODUCT THEREOF AND ARTICLE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-05-17 | — | — | EP | disclosed |