⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20658020 | 0.79 | — | — | |
| SCHEMBL73307 | 0.74 | — | — | |
| SCHEMBL5608116 | 0.74 | — | — | |
| SCHEMBL4195019 | 0.72 | CYP3A4 (0.35) | — | |
| Water SCHEMBL26127007 | 0.71 | — | — | |
| SCHEMBL7763078 | 0.71 | — | — | |
| SCHEMBL19532755 | 0.71 | CYP3A4 (0.32) | — | |
| SCHEMBL5416953 | 0.71 | — | — | |
| SCHEMBL14025858 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL28456441 | 0.69 | TSHR (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-8729195-B2 | Organosilicon compound, method for producing thereof, and curable silicone composition containing the same | DOW CORNING TORAY CO., LTD. (JP) | 2014-05-20 | — | — | US | disclosed |
| US-20120309921-A1 | Organosilicon Compound, Method For Producing Thereof, And Curable Silicone Composition Containing The Same | DOW CORNING TORAY CO., LTD. (JP) | 2012-12-06 | — | — | US | disclosed |