⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL81709 | 0.82 | — | — | |
| SCHEMBL81743 | 0.77 | — | — | |
| SCHEMBL15902363 | 0.74 | — | — | |
| SCHEMBL20162406 | 0.73 | — | — | |
| SCHEMBL15477640 | 0.72 | — | — | |
| SCHEMBL6037556 | 0.72 | — | — | |
| SCHEMBL1155309 | 0.72 | — | — | |
| SCHEMBL15477605 | 0.72 | — | — | |
| SCHEMBL4015991 | 0.68 | — | — | |
| SCHEMBL17962155 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995014700-A1 | NOVEL SILOXANES AND METHODS FOR THE PREPARATION THEREOF, THE USE OF SILOXANES IN COATING COMPOSITIONS, THE COATING COMPOSITIONS THUS OBTAINED AND THE USE OF SAID COATING COMPOSITIONS IN COATING SUBSTRATES OR PRODUCTS, TOGETHER WITH THE SUBSTRATES AND PRODUCTS THUS COATED | NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) | 1995-06-01 | — | — | WO | disclosed |