⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5697169 | 1.00 | — | — | |
| SCHEMBL57923 | 0.80 | TSHR (0.32) | — | |
| SCHEMBL22492983 | 0.80 | TSHR (0.32) | — | |
| SCHEMBL9452448 | 0.78 | TSHR (0.30) | — | |
| SCHEMBL9786112 | 0.76 | AR (0.33) | — | |
| Isopropyl Alcohol SCHEMBL28569032 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL9452078 | 0.75 | — | — | |
| SCHEMBL6052811 | 0.75 | MEN1 (0.38) | — | |
| SCHEMBL22443202 | 0.74 | — | — | |
| SCHEMBL81639 | 0.74 | — | — |
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 125 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4246189-A | FOR EASE OF MATERIALS HANDLING | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) | 1981-01-20 | — | — | US | claimed |
| WO-2024047657-A1 | PROCESS FOR THE PREPARATION OF NITISINONE | BRAWN LABORATORIES LTD (IN) | 2024-03-07 | — | — | WO | disclosed |
| EP-1160235-B1 | A method for producing alpha-hydroxycarboxylic acid | NIPPON CATALYTIC CHEM IND (JP) | 2006-09-20 | — | — | EP | disclosed |
| US-6864389-B2 | Method for producing α-hydroxycarboxylic acid | NIPPON SHOKUBAI CO., LTD. (JP) | 2005-03-08 | — | — | US | disclosed |
| US-20030171614-A1 | Method for producing alpha-hydroxycarboxylic acid | NIPPON SHOKUBAI CO., LTD. | 2003-09-11 | — | — | US | disclosed |
| US-6337196-B1 | REACTION OF KETONE WITH CYANIDE TO FORM CYANOHYDRIN | DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) | 2002-01-08 | — | — | US | disclosed |
| EP-1160235-A2 | A method for producing alpha-hydroxycarboxylic acid | Nippon Shokubai Co., Ltd. (JP) | 2001-12-05 | — | — | EP | disclosed |
| US-6291400-B1 | Herbicidal compounds | ZENECA LIMITED (GB) | 2001-09-18 | — | — | US | disclosed |
| US-6225095-B1 | REACTING ALDEHYDE OR KETONE DISSOLVED IN AN ORGANIC, WATER-IMMISCIBLE OR SLIGHTLY MISCIBLE DILUENT, AN AQUEOUS HYDROXYNITRILE LYASE SOLUTION, AND A CYANIDE GROUP DONOR TO FORM AN EMULSION WHICH IS MAINTAINED BY STIRRING | DSM FINE CHEMICALS AUSTRIA GMBH (AT) | 2001-05-01 | — | — | US | disclosed |
| US-5958839-A | HERBICIDALLY ACTIVE SUBSTITUTED CYCLIC DIONES | ZENECA LITMITED (GB) | 1999-09-28 | — | — | US | disclosed |
| EP-0252298-A2 | Certain 2-benzoyl-1,3,5-cyclohexanetriones | STAUFFER CHEMICAL COMPANY (US) | 1988-01-13 | — | — | EP | disclosed |
| EP-0249812-A2 | Certain 4-oxo-3-benzoylvalerolactones and thiolactones | STAUFFER CHEMICAL COMPANY (US) | 1987-12-23 | — | — | EP | disclosed |
| US-4708732-A | 2-(pyrimidinecarbonyl)-1,3-cyclohexanediones and their use as herbicidal agents | STAUFFER CHEMICAL COMPANY (US) | 1987-11-24 | — | — | US | disclosed |
| US-4695673-A | Process for the production of acylated 1,3-dicarbonyl compounds | STAUFFER CHEMICAL COMPANY (US) | 1987-09-22 | — | — | US | disclosed |
| EP-0186119-A2 | Certain 2-(2'substituted benzoyl)-1,3-cyclohexanediones | STAUFFER CHEMICAL COMPANY (US) | 1986-07-02 | — | — | EP | disclosed |
| EP-0186118-A2 | Certain 2-(2'nitrobenzoyl)-1,3-cyclohexanediones | STAUFFER CHEMICAL COMPANY (US) | 1986-07-02 | — | — | EP | disclosed |
| EP-0186120-A1 | Certain-2-(2'-alkylbenzoyl)-1,3-cyclohexanediones | STAUFFER CHEMICAL COMPANY (US) | 1986-07-02 | — | — | EP | disclosed |
| EP-0186117-A2 | Process for the production of acylated diketonic compounds | STAUFFER CHEMICAL COMPANY (US) | 1986-07-02 | — | — | EP | disclosed |
| US-4272435-A | Process for the preparation of azo compounds from amino compounds in the presence of a phase transfer catalyst | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1981-06-09 | — | — | US | disclosed |
| US-4246189-A | FOR EASE OF MATERIALS HANDLING | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) | 1981-01-20 | — | — | US | disclosed |