⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20996816 | 0.88 | POLB (0.32) | — | |
| SCHEMBL2399001 | 0.88 | — | — | |
| SCHEMBL27914325 | 0.85 | POLB (0.31) | — | |
| SCHEMBL4639321 | 0.83 | — | — | |
| SCHEMBL2703302 | 0.78 | — | — | |
| SCHEMBL15189343 | 0.76 | — | — | |
| SCHEMBL9674837 | 0.76 | — | — | |
| SCHEMBL28611363 | 0.73 | SUCNR1 (0.50) | — | |
| SCHEMBL9868039 | 0.73 | CYP2C19 (0.38) | — | |
| SCHEMBL2881231 | 0.71 | PPP5C (0.30) | — |
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 102 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4342886-A1 | METHOD FOR PRODUCING 1,4-DIOXANE DERIVATIVE, 1,4-DIOXANE DERIVATIVE, AND COMPOSITION CONTAINING 1,4-DIOXANE DERIVATIVE, METHOD FOR PRODUCING (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE, (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE, AND COMPOSITION CONTAINING (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE | Tosoh Corporation (JP) | 2024-03-27 | — | — | EP | claimed |
| CN-117355511-A | Method for producing 1, 4-dioxane derivative, composition containing 1, 4-dioxane derivative, method for producing (1, 3-dioxolane) -2-carboxylic acid derivative, and composition containing (1, 3-dioxolane) -2-carboxylic acid derivative | 东曹株式会社 | 2024-01-05 | — | — | CN | claimed |
| US-3989637-A | CARBOXYLATED LACTONES | MONSANTO COMPANY (US) | 1976-11-02 | — | — | US | claimed |
| JP-1316375-A | — | — | None | — | — | JP | disclosed |
| WO-2024216467-A1 | SEPARATOR, BATTERY CELL, BATTERY, AND ELECTRIC DEVICE | 宁德时代新能源科技股份有限公司 | 2024-10-24 | — | — | WO | disclosed |
| EP-4342886-A1 | METHOD FOR PRODUCING 1,4-DIOXANE DERIVATIVE, 1,4-DIOXANE DERIVATIVE, AND COMPOSITION CONTAINING 1,4-DIOXANE DERIVATIVE, METHOD FOR PRODUCING (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE, (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE, AND COMPOSITION CONTAINING (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE | Tosoh Corporation (JP) | 2024-03-27 | — | — | EP | disclosed |
| EP-4342886-A1 | METHOD FOR PRODUCING 1,4-DIOXANE DERIVATIVE, 1,4-DIOXANE DERIVATIVE, AND COMPOSITION CONTAINING 1,4-DIOXANE DERIVATIVE, METHOD FOR PRODUCING (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE, (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE, AND COMPOSITION CONTAINING (1,3-DIOXOLANE)-2-CARBOXYLIC ACID DERIVATIVE | Tosoh Corporation (JP) | 2024-03-27 | — | — | EP | disclosed |
| US-11912686-B2 | LPA receptor antagonists and uses thereof | GILEAD SCIENCES, INC. (US) | 2024-02-27 | — | — | US | disclosed |
| US-11912686-B2 | LPA receptor antagonists and uses thereof | GILEAD SCIENCES, INC. (US) | 2024-02-27 | — | — | US | disclosed |
| CN-117355511-A | Method for producing 1, 4-dioxane derivative, composition containing 1, 4-dioxane derivative, method for producing (1, 3-dioxolane) -2-carboxylic acid derivative, and composition containing (1, 3-dioxolane) -2-carboxylic acid derivative | 东曹株式会社 | 2024-01-05 | — | — | CN | disclosed |
| CN-117355511-A | Method for producing 1, 4-dioxane derivative, composition containing 1, 4-dioxane derivative, method for producing (1, 3-dioxolane) -2-carboxylic acid derivative, and composition containing (1, 3-dioxolane) -2-carboxylic acid derivative | 东曹株式会社 | 2024-01-05 | — | — | CN | disclosed |
| EP-0378765-A1 | Antagonists of leukotriene D4 | G.D. Searle & Co. (US) | 1990-07-25 | — | — | EP | disclosed |
| US-4923891-A | DIOXOLANE, DITHIOLANE AND OXATHIOLANE CARBOXYLATES, ANTIALLERGENS, ANTIINFLAMMATORIES | G. D. SEARLE & CO. (US) | 1990-05-08 | — | — | US | disclosed |
| JP-H01316375-A | 2-SUBSTITUTED-4-SUBSTITUTED-1,3-DIOXOLANES, AND SYNTHESIS AND USE THEREOF | IAF BIOCHEM INTERNATL INC | 1989-12-21 | — | — | JP | disclosed |
| US-4870098-A | ANTIALLERGY, ANTIINFLAMMATORY | G. D. SEARLE & CO. (US) | 1989-09-26 | — | — | US | disclosed |
| EP-0308956-A2 | Leukotriene LTD4 and LTB4 antagonists | G.D. Searle & Co. (US) | 1989-03-29 | — | — | EP | disclosed |
| US-4808729-A | ANTIALLERGENS, ANTIINFLAMMATORY AGENTS | G. D. SEARLE & CO. (US) | 1989-02-28 | — | — | US | disclosed |
| EP-0046488-A2 | Substituted 2,5,7-trioxa-bicyclo(2.2.2)octan-6-ones, 3,6,8-trioxa-bicyclo(3.2.1)octan-4-ones and 1,3-dioxane-carboxylic acid and 1,3-dioxolane-2-carboxylic acid compounds, and their preparation | HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) | 1982-03-03 | — | — | EP | disclosed |
| US-4225589-A | ANTITUMOR | RHONE-POULENC INDUSTRIES (FR) | 1980-09-30 | — | — | US | disclosed |
| US-3989637-A | CARBOXYLATED LACTONES | MONSANTO COMPANY (US) | 1976-11-02 | — | — | US | disclosed |