⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1328 | 0.82 | — | — | |
| SCHEMBL28818979 | 0.77 | — | — | |
| SCHEMBL28175530 | 0.77 | — | — | |
| SCHEMBL28232724 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL27739220 | 0.77 | — | — | |
| SCHEMBL28907156 | 0.77 | — | — | |
| SCHEMBL27724606 | 0.77 | — | — | |
| Trimethylammonium SCHEMBL27347324 | 0.75 | — | — | |
| Trimethylammonium SCHEMBL14764499 | 0.72 | — | — | |
| Allyl Alcohol SCHEMBL6036769 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102850802-A | Room temperature curable organopolysiloxane composition and gas separation membrane | SHINETSU CHEMICAL CO | 2013-01-02 | — | — | CN | disclosed |
| CN-102575105-A | Organosiloxane compositions | DOW CORNING | 2012-07-11 | — | — | CN | disclosed |
| CN-1170888-C | Copolymer-dispersed polysiloxane and sealant containing the same | ��������ķ������ | 2004-10-13 | — | — | CN | disclosed |