⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5087014 | 0.95 | — | — | |
| SCHEMBL821051 | 0.77 | — | — | |
| SCHEMBL3808943 | 0.76 | — | — | |
| SCHEMBL21489541 | 0.76 | — | — | |
| SCHEMBL15537104 | 0.70 | — | — | |
| Methacrylic Acid SCHEMBL12501960 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL8168449 | 0.66 | — | — | |
| SCHEMBL268640 | 0.65 | — | — | |
| SCHEMBL8523778 | 0.65 | — | — | |
| SCHEMBL17163520 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5994570-A | PLATINUM-VINYL SILOXANE COMPLEX AND A LOW MOLECULAR WEIGHT CHAIN OR CYCLIC VINYL SILOXANE BLENDED THEREWITH IN SUCH AN AMOUNT AS TO GIVE A VINYL GROUP TO PLATINUM ATOM RATIO OF FROM 0.5 TO 10 MOL/ATOM. | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1999-11-30 | — | — | US | disclosed |