⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4280756 | 0.72 | — | — | |
| Bromoform SCHEMBL8874563 | 0.61 | — | — | |
| Bromoform SCHEMBL18691 | 0.61 | — | — | |
| SCHEMBL1519 | 0.58 | — | — | |
| SCHEMBL1131509 | 0.58 | — | — | |
| Bromoform SCHEMBL29018896 | 0.55 | — | — | |
| SCHEMBL14963 | 0.55 | — | — | |
| Bromoform SCHEMBL30241098 | 0.55 | — | — | |
| Hydrochloric Acid SCHEMBL30602532 | 0.55 | — | — | |
| SCHEMBL95259 | 0.55 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6696436-B1 | TRIENE STEROIDS ADMINISTERED AS ANTICARCINOGENIC OR ANTIPROLIFERATIVE AGENTS AND AS ANTINEOGENESIS INHIBITORS; SIDE EFFECT REDUCTION | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES | 2004-02-24 | — | — | US | disclosed |
| US-6639094-B2 | Process for producing α-aminoketone derivatives | AJINOMOTO CO., INC. (JP) | 2003-10-28 | — | — | US | disclosed |
| EP-1348691-A1 | PROCESS FOR PRODUCING ALPHA-AMINOHALOMETHYL KETONE DERIVATIVES | Ajinomoto Co., Inc. (JP) | 2003-10-01 | — | — | EP | disclosed |
| US-6538160-B2 | Process for producing α-aminohalomethyl ketone derivatives | AJINOMOTO CO., INC. (JP) | 2003-03-25 | — | — | US | disclosed |
| US-20020035296-A1 | Process for producing alpha-aminohalomethyl ketone derivatives | AJINOMOTO CO., INC. (JP) | 2002-03-21 | — | — | US | disclosed |
| US-20020026081-A1 | Process for producing alpha-aminoketone derivatives | AJINOMOTO CO., INC. (JP) | 2002-02-28 | — | — | US | disclosed |
| WO-2001030803-A1 | B-HOMOESTRA-1,3,5(10)-TRIENES AS MODULATORS OF TUBULIN POLYMERIZATION | THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2001-05-03 | — | — | WO | disclosed |
| EP-0653415-B1 | (Aryl-[1'-(aryl)-alkyl]-methylidene)- or (aryl-[1'(aryl)alkyl]-methyl)-dicarboxylic acid alkyl ester or their thiocarboxylic acid esters, process for their preparation and their use | THIEMANN ARZNEIMITTEL GMBH (DE) | 1998-06-24 | — | — | EP | disclosed |
| EP-0653415-A1 | Aryl-1'-(aryl)-alkyl-methylidene- or aryl-1'(aryl)alkyl-methyl-dicarboxylic acid alkyl ester or their thiocarboxylic acid esters, process for their preparation and their use | Thiemann Arzneimittel GmbH (DE) | 1995-05-17 | — | — | EP | disclosed |
| EP-0260121-B1 | INOSOSE DERIVATIVES, PRODUCTION AND USE THEREOF | Takeda Chemical Industries, Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |
| US-5004838-A | Inosose derivatives, production and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1991-04-02 | — | — | US | disclosed |
| US-4898986-A | Inosose derivatives, production and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-02-06 | — | — | US | disclosed |
| EP-0260121-A2 | Inosose derivatives, production and use thereof | Takeda Chemical Industries, Ltd. (JP) | 1988-03-16 | — | — | EP | disclosed |
| US-4537773-A | α-Aminoboronic acid derivatives | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-08-27 | — | — | US | disclosed |