⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL757147 | 0.98 | BCHE (0.30) | — | |
| SCHEMBL809786 | 0.90 | CCR5 (0.31) | — | |
| Bromide SCHEMBL14993435 | 0.88 | CCR5 (0.30) | — | |
| SCHEMBL2420361 | 0.88 | CCR5 (0.33) | — | |
| Hydrochloric Acid SCHEMBL1691842 | 0.88 | CCR5 (0.33) | — | |
| SCHEMBL809788 | 0.87 | CCR5 (0.35) | — | |
| SCHEMBL809728 | 0.87 | CCR5 (0.35) | — | |
| SCHEMBL810033 | 0.87 | CCR5 (0.35) | — | |
| SCHEMBL810056 | 0.87 | CCR5 (0.35) | — | |
| SCHEMBL809978 | 0.87 | CCR5 (0.35) | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9295981-B2 | Method for producing ester compound by reacting an unsaturated organic compound and a formic acid ester in the presence of a catalyst system containing a ruthenium compound, a cobalt compound and a halide salt | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2016-03-29 | — | — | US | disclosed |
| EP-2000453-B1 | METHOD FOR PRODUCING ALCOHOL BY USING CARBON DIOXIDE AS RAW MATERIAL | HITACHI CHEMICAL CO LTD (JP) | 2014-12-03 | — | — | EP | disclosed |
| EP-2808585-A1 | OIL SEAL FOR AUTOMOBILE | Daikin Industries, Ltd. (JP) | 2014-12-03 | — | — | EP | disclosed |
| US-8653301-B2 | Tricyclodecane monomethanol monocarboxylic acid and derivatives thereof | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2014-02-18 | — | — | US | disclosed |
| EP-2206694-B1 | METHOD FOR PRODUCING ALCOHOL USING CARBON DIOXIDE AS RAW MATERIAL | HITACHI CHEMICAL CO LTD (JP) | 2014-02-12 | — | — | EP | disclosed |
| US-20140031579-A1 | METHOD OF PRODUCING NORBORNANEDICARBOXYLIC ACID ESTER | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2014-01-30 | — | — | US | disclosed |
| EP-2492258-A1 | METHOD FOR MANUFACTURING A TRICYCLODECANE MONO-METHANOL MONOCARBOXYLIC ACID DERIVATIVE | Hitachi Chemical Company, Ltd. (JP) | 2012-08-29 | — | — | EP | disclosed |
| US-20120203026-A1 | METHOD FOR MANUFACTURING TRICYCLODECANE MONO-METHANOL MONOCARBOXYLIC ACID DERIVATIVE | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2012-08-09 | — | — | US | disclosed |
| EP-2474519-A1 | TRICYCLODECANE MONOMETHANOL MONOCARBOXYLIC ACID AND DERIVATIVES THEREOF | Hitachi Chemical Company, Ltd. (JP) | 2012-07-11 | — | — | EP | disclosed |
| US-20120157705-A1 | TRICYCLODECANE MONOMETHANOL MONOCARBOXYLIC ACID AND DERIVATIVES THEREOF | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2012-06-21 | — | — | US | disclosed |
| US-20120123146-A1 | METHOD FOR PRODUCING ESTER COMPOUND | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2012-05-17 | — | — | US | disclosed |
| EP-2206694-A1 | METHOD FOR PRODUCING ALCOHOL USING CARBON DIOXIDE AS RAW MATERIAL | Hitachi Chemical Company, Ltd. (JP) | 2010-07-14 | — | — | EP | disclosed |
| EP-2000453-A9 | METHOD FOR PRODUCING ALCOHOL BY USING CARBON DIOXIDE AS RAW MATERIAL | Hitachi Chemical Co., Ltd. (JP) | 2009-03-11 | — | — | EP | disclosed |
| EP-2000453-A2 | METHOD FOR PRODUCING ALCOHOL BY USING CARBON DIOXIDE AS RAW MATERIAL | Hitachi Chemical Co., Ltd. (JP) | 2008-12-10 | — | — | EP | disclosed |
| EP-1291401-A1 | FLUORORUBBER COATING COMPOSITION | Daikin Industries, Ltd. (JP) | 2003-03-12 | — | — | EP | disclosed |
| EP-1245634-A1 | WATER-BASED COMPOSITION FOR FLUORORUBBER VULCANIZATION AND ARTICLE COATED WITH FLUORORUBBER | Daikin Industries, Ltd. (JP) | 2002-10-02 | — | — | EP | disclosed |
| EP-0769517-B1 | SURFACE-MODIFIED FLUORORESIN MOLDED PRODUCT | DAIKIN IND LTD (JP) | 2002-09-18 | — | — | EP | disclosed |
| EP-0769517-A1 | SURFACE-MODIFIED FLUORORESIN MOLDED PRODUCT | DAIKIN INDUSTRIES, LTD. (JP) | 1997-04-23 | — | — | EP | disclosed |