⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10977197 | 0.74 | SLC6A3 (0.31) | — | |
| SCHEMBL4185299 | 0.72 | SLC6A3 (0.32) | — | |
| SCHEMBL4490629 | 0.70 | — | — | |
| SCHEMBL8978207 | 0.68 | HPGD (0.36) | — | |
| Methane SCHEMBL8941744 | 0.67 | — | — | |
| SCHEMBL28855038 | 0.67 | — | — | |
| SCHEMBL277911 | 0.66 | SLC6A3 (0.31) | — | |
| SCHEMBL6268479 | 0.66 | — | — | |
| SCHEMBL23070865 | 0.64 | — | — | |
| SCHEMBL1799712 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0260218-B1 | METHOD FOR MOLDING USING A DUAL SOLID FLOWABLE POLYMER SYSTEM | UNITED TECHNOLOGIES CORPORATION (US) | 1991-05-08 | — | — | EP | claimed |
| US-4770835-A | MOLDING COMPOSITES, UNIFORM PRESSURE EXERTED BY POLYMER PARTICLES | UNITED TECHNOLOGIES CORPORATION (US) | 1988-09-13 | — | — | US | claimed |
| EP-0241207-B1 | PROCESS FOR MOLDING SILICONE RUBBER COMPOSITIONS | Toray Silicone Company, Ltd. (JP) | 1991-03-13 | — | — | EP | disclosed |