⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL426696 | 0.93 | — | — | |
| SCHEMBL4272683 | 0.77 | — | — | |
| Trifluoroacetic Acid SCHEMBL27580311 | 0.76 | ALDH1A1 (0.39) | — | |
| SCHEMBL31272236 | 0.73 | — | — | |
| Trifluoroacetic Acid SCHEMBL28075338 | 0.72 | KCNN4 (0.38) | — | |
| SCHEMBL7057624 | 0.71 | — | — | |
| Trifluoroacetic Acid SCHEMBL6200119 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL329291 | 0.71 | CA2 (0.30) | — | |
| Trifluoroacetic Acid SCHEMBL5165952 | 0.70 | FFAR3 (0.37) | — | |
| Trifluoroacetic Acid SCHEMBL72727 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20140256844-A1 | NOVEL SILICONE POLYETHER COPOLYMERS AND PROCESS FOR PREPARATION THEREOF | EVONIK DEGUSSA GMBH (DE) | 2014-09-11 | — | — | US | disclosed |
| US-8779079-B2 | Silicone polyether copolymers and process for preparation thereof | EVONIK DEGUSSA GMBH (DE) | 2014-07-15 | — | — | US | disclosed |
| EP-1608716-B1 | PROCESS FOR THE PREPARATION OF POLY(SILYL ESTER)S, AND THEIR USES | SIGMAKALON B V (NL) | 2011-11-16 | — | — | EP | disclosed |
| US-20110263605-A1 | Azabicyclo[2.2.1]Heptane Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands | BRISTOL-MYERS SQUIBB COMPANY | 2011-10-27 | — | — | US | disclosed |
| US-7902313-B2 | Process for the preparation of poly(silyl ester)s, and their uses | SIGMAKALON B.V. (NL) | 2011-03-08 | — | — | US | disclosed |
| US-20110021693-A1 | NOVEL SILICONE POLYETHER COPOLYMERS AND PROCESS FOR PREPARATION THEREOF | EVONIK GOLDSCHMIDT GMBH (DE) | 2011-01-27 | — | — | US | disclosed |
| US-20060241240-A1 | Process for the preparation of poly(silyl ester)s, and their uses | SIGMA KALON B.V. (NL) | 2006-10-26 | — | — | US | disclosed |