⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2881054 | 1.00 | — | — | |
| SCHEMBL13911335 | 1.00 | — | — | |
| Alcohol SCHEMBL3688305 | 0.94 | FAAH (0.33) | — | |
| SCHEMBL13911337 | 0.77 | — | — | |
| SCHEMBL9634063 | 0.77 | FAAH (0.32) | — | |
| SCHEMBL2881564 | 0.77 | — | — | |
| SCHEMBL2883913 | 0.77 | — | — | |
| SCHEMBL13905060 | 0.77 | — | — | |
| SCHEMBL2881563 | 0.77 | — | — | |
| SCHEMBL2883564 | 0.77 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2010536910-A | — | — | 2010-12-02 | — | — | JP | claimed |
| EP-2197831-A1 | PROCESS FOR PREPARING ESTROGEN-ANTAGONISTIC 11 BETA-FLUORO-17 ALPHA-ALKYLESTRA-1,3,5(10)-TRIENE-3,17-DIOLS HAVING A 7 ALPHA-(XI-ALKYLAMINO-OMEGA-PERFLUOROALKYL)ALKYL SIDE CHAIN AND ALPHA-ALKYL(AMINO)-OMEGA-PERFLUORO(ALKYL)ALKANES AND PROCESSES FOR THEIR PREPARATION | Bayer Schering Pharma Aktiengesellschaft (DE) | 2010-06-23 | — | — | EP | claimed |
| EP-2033948-A1 | Process for preparing Estrogen-antagonistic 11beta-Fluoro-17alpha-alkylestra-1,3,5 (10)-triene-3, 17-diols having a 7alpha-(xi-Alkylamino-omega-perfluoroalkyl)alkyl side chain and alpha-Alkyl(amino)-omega-perfluoro(alkyl)alkanes and processes for their preparation | Bayer Schering Pharma Aktiengesellschaft (DE) | 2009-03-11 | — | — | EP | claimed |
| WO-2009027108-A1 | PROCESS FOR PREPARING ESTROGEN-ANTAGONISTIC 11 β-FLUORO-17α-ALKYLESTRA-1,3,5(10)-TRIENE-3,17-DIOLS HAVING A 7α-(ξ-ALKYLAMINO-ω-PERFLUOROALKYL)ALKYL SIDE CHAIN AND α-ALKYL(AMINO)-ω-PERFLUORO(ALKYL)ALKANES AND PROCESSES FOR THEIR PREPARATION | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-05 | — | — | WO | claimed |
| US-20090062558-A1 | Process for preparing Estrogen-antagonistic 11 beta-Fluoro-17alpha-alkylestra-1,3,5(10)-triene-3,17-diols having a 7alpha-(xi-Alkylamino-omega-perfluoroalkyl)alkyl side chain and alpha-Alkyl(amino)-omega-perfluoro(alkyl)alkanes and Processes for their Preparation | BAYER SCHERING PHARMA AG (DE) | 2009-03-05 | — | — | US | claimed |
| EP-2197831-A1 | PROCESS FOR PREPARING ESTROGEN-ANTAGONISTIC 11 BETA-FLUORO-17 ALPHA-ALKYLESTRA-1,3,5(10)-TRIENE-3,17-DIOLS HAVING A 7 ALPHA-(XI-ALKYLAMINO-OMEGA-PERFLUOROALKYL)ALKYL SIDE CHAIN AND ALPHA-ALKYL(AMINO)-OMEGA-PERFLUORO(ALKYL)ALKANES AND PROCESSES FOR THEIR PREPARATION | Bayer Schering Pharma Aktiengesellschaft (DE) | 2010-06-23 | — | — | EP | disclosed |
| EP-2033948-A1 | Process for preparing Estrogen-antagonistic 11beta-Fluoro-17alpha-alkylestra-1,3,5 (10)-triene-3, 17-diols having a 7alpha-(xi-Alkylamino-omega-perfluoroalkyl)alkyl side chain and alpha-Alkyl(amino)-omega-perfluoro(alkyl)alkanes and processes for their preparation | Bayer Schering Pharma Aktiengesellschaft (DE) | 2009-03-11 | — | — | EP | disclosed |
| WO-2009027108-A1 | PROCESS FOR PREPARING ESTROGEN-ANTAGONISTIC 11 β-FLUORO-17α-ALKYLESTRA-1,3,5(10)-TRIENE-3,17-DIOLS HAVING A 7α-(ξ-ALKYLAMINO-ω-PERFLUOROALKYL)ALKYL SIDE CHAIN AND α-ALKYL(AMINO)-ω-PERFLUORO(ALKYL)ALKANES AND PROCESSES FOR THEIR PREPARATION | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-05 | — | — | WO | disclosed |
| US-20090062558-A1 | Process for preparing Estrogen-antagonistic 11 beta-Fluoro-17alpha-alkylestra-1,3,5(10)-triene-3,17-diols having a 7alpha-(xi-Alkylamino-omega-perfluoroalkyl)alkyl side chain and alpha-Alkyl(amino)-omega-perfluoro(alkyl)alkanes and Processes for their Preparation | BAYER SCHERING PHARMA AG (DE) | 2009-03-05 | — | — | US | disclosed |