⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26221250 | 0.69 | — | — | |
| SCHEMBL23815525 | 0.69 | — | — | |
| SCHEMBL16093279 | 0.69 | — | — | |
| SCHEMBL19215247 | 0.69 | — | — | |
| SCHEMBL18552960 | 0.69 | — | — | |
| SCHEMBL1342663 | 0.67 | — | — | |
| SCHEMBL21424233 | 0.67 | — | — | |
| SCHEMBL1343930 | 0.67 | — | — | |
| SCHEMBL2686903 | 0.67 | — | — | |
| SCHEMBL28469804 | 0.67 | TSHR (0.30) | — |
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-6699956-B2 | ORGANOPOLYSILOXANE CONTAINING A CYANOALKYL GROUP AND A MONOVALENT HYDROCARBON GROUP HAVING AN ALIPHATIC UNSATURATED BOND, ORGANOHYDROGENPOLYSILOXANE CONTAINING A CYANOALKYL GROUP, PLATINUM GROUP METAL CATALYST | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2004-03-02 | — | — | US | disclosed |
| US-20020198319-A1 | Highly dielectric addition type curable compositions | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-12-26 | — | — | US | disclosed |