⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27542242 | 0.97 | ALDH1A1 (0.42) | — | |
| Acetone SCHEMBL1092274 | 0.94 | ALDH1A1 (0.40) | — | |
| SCHEMBL27859314 | 0.84 | CYP2C9 (0.39) | — | |
| SCHEMBL4471217 | 0.79 | TSHR (0.33) | — | |
| SCHEMBL9114520 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL27485526 | 0.78 | KMO (0.42) | — | |
| SCHEMBL9416833 | 0.76 | ALDH1A1 (0.47) | — | |
| SCHEMBL6056744 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL6056737 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL318619 | 0.73 | — | — |
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 104 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104926736-B | A kind of synthetic method of Fluoxastrobin and its intermediate | 重庆紫光化工股份有限公司 | 2019-05-17 | — | — | CN | claimed |
| EP-2134760-B1 | COMPOSITION CONTAINING A MODIFIED (POLY)ISOCYANATE AND A SOLVENT OF THE ACETAL OR ALIPHATIC KETONE TYPE, AND USE OF SAID COMPOSITION FOR PRODUCING COATINGS | VENCOREX FRANCE (FR) | 2018-09-26 | — | — | EP | claimed |
| EP-1999173-B1 | MIXTURE BASED ON POLYISOCYANATE AND AN ACETAL SOLVENT, AQUEOUS EMULSION OBTAINED FROM THIS MIXTURE, AND USE OF THIS EMULSION FOR PRODUCING COATINGS AND ADHESIVES | RHODIA OPERATIONS (FR) | 2010-02-17 | — | — | EP | claimed |
| WO-2005087711-A1 | METHOD FOR THE PRODUCTION OF ACETAMIDE ACETALS | DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) | 2005-09-22 | — | — | WO | claimed |
| EP-0185596-B1 | MATERIAL FOR STORING THERMAL ENERGY AND PROCESS FOR PROTECTING COMPONENTS, ESPECIALLY ELECTRIC AND ELECTRONIC ONES, AGAINST THERMAL SHOCKS | ASSOCIATION POUR LA RECHERCHE ET LE DEVELOPPEMENT DES METHODES ET PROCESSUS INDUSTRIELS (ARMINES) (FR) | 1989-05-03 | — | — | EP | claimed |
| US-12110280-B2 | AI assisted cyclic carbonate monomer synthesis | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2024-10-08 | — | — | US | disclosed |
| US-20240067646-A1 | COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY | HOFFMANN-LA ROCHE INC. | 2024-02-29 | — | — | US | disclosed |
| US-11753407-B2 | Compounds for treating spinal muscular atrophy | PTC THERAPEUTICS, INC. (US) | 2023-09-12 | — | — | US | disclosed |
| WO-2023160672-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY | LHOTSE BIO , INC. (US) | 2023-08-31 | — | — | WO | disclosed |
| CN-116507671-A | Polycarbonate resin composition | 旭化成株式会社 | 2023-07-28 | — | — | CN | disclosed |
| US-20230234952-A1 | PARP1 INHIBITORS AND USES THEREOF | XINTHERA, INC. | 2023-07-27 | — | — | US | disclosed |
| CN-110804022-B | Preparation method of dexrazoxane | 扬子江药业集团有限公司 | 2023-01-17 | — | — | CN | disclosed |
| EP-0532178-B1 | Methanoanthracenes as dopamine antagonists | ZENECA LTD (GB) | 1996-10-16 | — | — | EP | disclosed |
| US-5455246-A | Treating neuropsychiatric disorders | IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) | 1995-10-03 | — | — | US | disclosed |
| US-5266570-A | Neuropsychiatric disorders | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-11-30 | — | — | US | disclosed |
| EP-0547126-A1 | POLYMERS CONTAINING DIESTER UNITS. | NYCOMED IMAGING AS (NO) | 1993-06-23 | — | — | EP | disclosed |
| EP-0532178-A1 | Methanoanthracenes as dopamine antagonists | ZENECA LIMITED (GB) | 1993-03-17 | — | — | EP | disclosed |
| WO-1992004392-A1 | POLYMERS CONTAINING DIESTER UNITS | HOLMES, MICHAEL, JOHN (GB) | 1992-03-19 | — | — | WO | disclosed |
| EP-0383239-A1 | Isomeric dideoxynucleosides, their preparation and their use in medicaments | F. HOFFMANN-LA ROCHE AG (CH) | 1990-08-22 | — | — | EP | disclosed |
| US-4304928-A | 2-Alkoxyacrylate process | CHEVRON RESEARCH COMPANY (US) | 1981-12-08 | — | — | US | disclosed |