⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14778173 | 0.94 | CA1 (0.36) | — | |
| SCHEMBL14523162 | 0.92 | CA1 (0.34) | — | |
| SCHEMBL26196 | 0.88 | — | — | |
| SCHEMBL25886 | 0.84 | ALDH1A1 (0.44) | — | |
| SCHEMBL2754170 | 0.82 | ALDH1A1 (0.54) | — | |
| SCHEMBL18282347 | 0.82 | TSHR (0.33) | — | |
| SCHEMBL3093222 | 0.80 | ALDH1A1 (0.58) | — | |
| SCHEMBL1668995 | 0.80 | ALDH1A1 (0.58) | — | |
| SCHEMBL14779341 | 0.80 | ALDH1A1 (0.58) | — | |
| SCHEMBL6896512 | 0.80 | ALDH1A1 (0.58) | — |
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 185 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9388105-B2 | Production of hydroxy ether hydrocarbons by liquid phase hydrogenolysis of cyclic acetals or cyclic ketals | EASTMAN CHEMICAL COMPANY (US) | 2016-07-12 | — | — | US | claimed |
| US-8969598-B2 | Production of cyclic acetals or ketals using liquid-phase acid catalysts | EASTMAN CHEMICAL COMPANY (US) | 2015-03-03 | — | — | US | claimed |
| US-8829207-B2 | Production of cyclic acetals by reactive distillation | EASTMAN CHEMICAL COMPANY (US) | 2014-09-09 | — | — | US | claimed |
| US-8829206-B2 | Production of cyclic acetals or ketals using solid acid catalysts | EASTMAN CHEMICAL COMPANY (US) | 2014-09-09 | — | — | US | claimed |
| US-20130102641-A1 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | XENOPORT, INC. (US) | 2013-04-25 | — | — | US | claimed |
| US-20120330034-A1 | PRODUCTION OF CYCLIC ACETALS BY REACTIVE DISTILLATION | EASTMAN CHEMICAL COMPANY (US) | 2012-12-27 | — | — | US | claimed |
| WO-2012177469-A1 | PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY LIQUID PHASE HYDROGENOLYSIS OF CYCLIC ACETALS OR CYCLIC KETALS | EASTMAN CHEMICAL COMPANY (US) | 2012-12-27 | — | — | WO | claimed |
| WO-2012177485-A1 | PRODUCTION OF CYCLIC ACETALS OR KETALS USING LIQUID-PHASE ACID CATALYSTS | EASTMAN CHEMICAL COMPANY (US) | 2012-12-27 | — | — | WO | claimed |
| WO-2012177417-A1 | PRODUCTION OF CYCLIC ACETALS OR KETALS USING SOLID ACID CATALYSTS | EASTMAN CHEMICAL COMPANY (US) | 2012-12-27 | — | — | WO | claimed |
| US-20120330032-A1 | PRODUCTION OF CYCLIC ACETALS OR KETALS USING SOLID ACID CATALYSTS | EASTMAN CHEMICAL COMPANY (US) | 2012-12-27 | — | — | US | claimed |
| US-20120330033-A1 | PRODUCTION OF CYCLIC ACETALS OR KETALS USING LIQUID-PHASE ACID CATALYSTS | EASTMAN CHEMICAL COMPANY (US) | 2012-12-27 | — | — | US | claimed |
| US-20120330069-A1 | PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY LIQUID PHASE HYDROGENOLYSIS OF CYCLIC ACETALS OR CYCLIC KETALS | EASTMAN CHEMICAL COMPANY (US) | 2012-12-27 | — | — | US | claimed |
| US-20110245249-A1 | Heterocyclically Substituted Anilinopyrimidines | BAYER CROPSCIENCE AG (DE) | 2011-10-06 | — | — | US | claimed |
| US-7790708-B2 | Prodrugs of GABA analogs, compositions and uses thereof | XENOPORT, INC. (US) | 2010-09-07 | — | — | US | claimed |
| EP-1902714-A1 | Prodrugs of gaba analogs, compositions and uses thereof | Xenoport, Inc. (US) | 2008-03-26 | — | — | EP | claimed |
| EP-1404324-B1 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | XENOPORT INC (US) | 2007-12-05 | — | — | EP | claimed |
| US-7060727-B2 | Prodrugs of fused GABA analogs, pharmaceutical compositions and uses thereof | XENOPORT, INC. (US) | 2006-06-13 | — | — | US | claimed |
| US-20040147455-A1 | Prodrugs of fused GABA analogs, pharmaceutical compositions and uses thereof | XENOPORT, INC. | 2004-07-29 | — | — | US | claimed |
| WO-2004052360-A1 | PRODRUGS OF FUSED GABA ANALOGS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | XENOPORT, INC. (US) | 2004-06-24 | — | — | WO | claimed |
| US-20030176398-A1 | Prodrugs of GABA analogs, compositions and uses thereof | HPS INVESTMENT PARTNERS, LLC, AS ADMINISTRATIVE AGENT | 2003-09-18 | — | — | US | claimed |