⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1049996 | 0.71 | — | — | |
| SCHEMBL1079604 | 0.65 | — | — | |
| SCHEMBL1044862 | 0.64 | — | — | |
| SCHEMBL1048341 | 0.64 | — | — | |
| SCHEMBL19405380 | 0.63 | — | — | |
| SCHEMBL1048372 | 0.61 | — | — | |
| SCHEMBL1050857 | 0.60 | — | — | |
| SCHEMBL1049994 | 0.59 | — | — | |
| SCHEMBL15992383 | 0.59 | — | — | |
| SCHEMBL1455391 | 0.59 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5047491-A | Molding materials; waterproofing, oil repellents, antifouling agents | CHISSO CORPORATION (JP) | 1991-09-10 | — | — | US | disclosed |
| US-4996280-A | Polyorganosiloxane compounds with amino group | CHISSO CORPORATION (JP) | 1991-02-26 | — | — | US | disclosed |
| EP-0355497-A2 | Polyorganosiloxane compounds | Chisso Corporation (JP) | 1990-02-28 | — | — | EP | disclosed |
| EP-0353709-A2 | Polyorganosiloxane compounds with amino group | Chisso Corporation (JP) | 1990-02-07 | — | — | EP | disclosed |