⚠ 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 | |
|---|---|---|---|---|
| Isopropyl Alcohol SCHEMBL17183857 | 0.94 | — | — | |
| Isopropyl Alcohol SCHEMBL9244874 | 0.88 | — | — | |
| Isopropyl Alcohol SCHEMBL890876 | 0.87 | ALDH1A1 (1.00) | — | |
| Isopropyl Alcohol SCHEMBL29500440 | 0.87 | — | — | |
| Isopropyl Alcohol SCHEMBL8329582 | 0.87 | ALDH1A1 (1.00) | — | |
| Isopropyl Alcohol SCHEMBL10729977 | 0.87 | ALDH1A1 (1.00) | — | |
| Isopropyl Alcohol SCHEMBL16914724 | 0.87 | — | — | |
| Isopropyl Alcohol SCHEMBL385 | 0.87 | — | — | |
| Isopropyl Alcohol SCHEMBL29814955 | 0.87 | — | — | |
| Isopropyl Alcohol SCHEMBL607689 | 0.87 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9708637-B2 | Method for producing lower alkyl ester | AJINOMOTO CO., INC. (JP) | 2017-07-18 | — | — | US | disclosed |
| US-20160265019-A1 | Method for Producing Amino Acids Using Bacterium of the Enterobacteriaceae Family | AJINOMOTO CO., INC. (JP) | 2016-09-15 | — | — | US | disclosed |
| US-9376695-B2 | L-amino acid producing bacterium | AJINOMOTO CO., INC. (JP) | 2016-06-28 | — | — | US | disclosed |
| US-20090137010-A1 | METHOD FOR PRODUCING AMINO ACIDS USING BACTERIUM OF THE ENTEROBACTERIACEAE FAMILY | AJINOMOTO CO., INC. (JP) | 2009-05-28 | — | — | US | disclosed |
| US-20070274973-A1 | METHOD OF CONTROLLING FUNGAL PATHOGENS, AND AGENTS USEFUL FOR SAME | THE AUSTRALIAN NATIONAL UNIVERSITY | 2007-11-29 | — | — | US | disclosed |
| US-20020137791-A1 | NEURAMINIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR MEDICAL USE | SANKYO COMPANY, LIMITED (JP) | 2002-09-26 | — | — | US | disclosed |
| US-6432952-B1 | CENTRAL NERVOUS SYSTEM DISORDERS; ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2002-08-13 | — | — | US | disclosed |
| EP-1228068-A1 | POLYMORPHIC FORM OF A TACHYKININ RECEPTOR ANTAGONIST | Merck & Co., Inc. (US) | 2002-08-07 | — | — | EP | disclosed |
| US-6340702-B1 | SIALIDASE INHIBITORS; ANTIVIRAL COMPOUNDS | SANKYO COMPANY, LIMITED (JP) | 2002-01-22 | — | — | US | disclosed |
| WO-2001032656-A1 | POLYMORPHIC FORM OF A TACHYKININ RECEPTOR ANTAGONIST | MERCK & CO., INC. (US) | 2001-05-10 | — | — | WO | disclosed |
| US-4579819-A | ONE-STEP PROCESS; SOLUBILIZER FOR GALLSTONES | KABUSHIKI KAISHA YAKULT HONSHA (JP) | 1986-04-01 | — | — | US | disclosed |
| US-4341788-A | CARDIOTONIC AGENTS; RETARDERS; ANTIARRHYTHMIA AGENTS | C. H. BOEHRINGER SOHN (DE) | 1982-07-27 | — | — | US | disclosed |