⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL203735 | 0.67 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL27908720 | 0.66 | — | — | |
| SCHEMBL3545623 | 0.65 | — | — | |
| Acetone SCHEMBL3081070 | 0.63 | ALDH1A1 (0.57) | — | |
| SCHEMBL6517758 | 0.63 | — | — | |
| SCHEMBL4748477 | 0.61 | ALDH1A1 (0.54) | — | |
| SCHEMBL20796 | 0.61 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL8322448 | 0.61 | ALDH1A1 (1.00) | — | |
| SCHEMBL4971363 | 0.61 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL3080739 | 0.61 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0069256-B1 | ONE PACKAGE, STABLE, MOISTURE CURABLE, POLYALKOXY-TERMINATED ORGANOPOLYSILOXANE COMPOSITIONS AND METHOD FOR MAKING | GENERAL ELECTRIC COMPANY (US) | 1988-09-07 | — | — | EP | claimed |
| US-4517352-A | STABILIZING SILANE SCAVENGER, CONDENSATION CATALYST; SEALANTS, CAULKING | GENERAL ELECTRIC COMPANY (US) | 1985-05-14 | — | — | US | claimed |
| EP-0137883-A1 | End-capping catalyst for forming alcoxy-functional one component RTV compositions | GENERAL ELECTRIC COMPANY (US) | 1985-04-24 | — | — | EP | claimed |
| US-4513115-A | ROOM TEMPERATURE VULCANIZABLE POLYALKOXY-TERMINATED POLYSILOXANE AND HYDROLIZABLE SCAVENGER, SHELF LIFE | GENERAL ELECTRIC COMPANY (US) | 1985-04-23 | — | — | US | claimed |
| US-4395526-A | SILANE SCAVENGER | GENERAL ELECTRIC COMPANY (US) | 1983-07-26 | — | — | US | claimed |
| WO-1983000156-A1 | ONE PACKAGE, STABLE, MOISTURE CURABLE, POLYALKOXY-TERMINATED ORGANOPOLYSILOXANE COMPOSITIONS AND METHOD FOR MAKING | GEN ELECTRIC (US) | 1983-01-20 | — | — | WO | claimed |
| EP-0069256-A2 | One package, stable, moisture curable, polyalkoxy-terminated organopolysiloxane compositions and method for making | GENERAL ELECTRIC COMPANY (US) | 1983-01-12 | — | — | EP | claimed |