⚠ 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 | |
|---|---|---|---|---|
| Ethylamine SCHEMBL11659087 | 0.91 | — | — | |
| SCHEMBL711225 | 0.91 | ALDH1A1 (0.50) | — | |
| SCHEMBL503606 | 0.91 | ALDH1A1 (0.50) | — | |
| Methane SCHEMBL1053204 | 0.88 | ALDH1A1 (0.48) | — | |
| SCHEMBL9420825 | 0.88 | ALDH1A1 (0.48) | — | |
| Water SCHEMBL5200164 | 0.88 | ALDH1A1 (0.48) | — | |
| SCHEMBL11180477 | 0.88 | ALDH1A1 (0.48) | — | |
| Selenium SCHEMBL11484547 | 0.88 | ALDH1A1 (0.48) | — | |
| SCHEMBL29143167 | 0.88 | ALDH1A1 (0.48) | — | |
| SCHEMBL15611174 | 0.88 | ALDH1A1 (0.48) | — |
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 160 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024140055-A1 | HIGH-TEMPERATURE-RESISTANT HYPERBRANCHED RETARDER FOR CONCRETE AND PREPARATION METHOD THEREFOR | 科之杰新材料集团有限公司 | 2024-07-04 | — | — | WO | claimed |
| JP-4118948-B2 | — | — | 2008-07-16 | — | — | JP | claimed |
| EP-1345913-A2 | HETEROCYCLIC COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Dr. Reddy's Laboratories Ltd. (IN) | 2003-09-24 | — | — | EP | claimed |
| WO-2002051819-A9 | HETEROCYCLIC COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | REDDYS LAB LTD DR (IN) | 2003-08-07 | — | — | WO | claimed |
| US-20030065175-A1 | Novel heterocyclic compounds having antibacterial activity: process for their preparation and pharmaceutical compositions containing them | DR. REDDY'S RESEARCH FOUNDATION | 2003-04-03 | — | — | US | claimed |
| EP-0861026-B1 | SYNERGISTIC HERBICIDAL MIXTURES CONTAINING CYCLOHEXENONE OXIME ETHER | BASF AG (DE) | 2003-04-02 | — | — | EP | claimed |
| EP-1066342-B1 | PHOTOSENSITIZER FOR APPLICATIONS IN SOLAR TECHNOLOGY, METHOD FOR THE PRODUCTION THEREOF AND CONFIGURATION TO IMPLEMENT THE METHOD | HAHN MEITNER INST BERLIN GMBH (DE) | 2002-09-04 | — | — | EP | claimed |
| WO-2002051819-A2 | HETEROCYCLIC COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DR. REDDY'S LABORATORIES LTD. (IN) | 2002-07-04 | — | — | WO | claimed |
| EP-1066342-A1 | PHOTOSENSITIZER FOR APPLICATIONS IN SOLAR TECHNOLOGY, METHOD FOR THE PRODUCTION THEREOF AND CONFIGURATION TO IMPLEMENT THE METHOD | Hahn-Meitner-Institut Berlin GmbH (DE) | 2001-01-10 | — | — | EP | claimed |
| JP-2000503297-A | — | — | 2000-03-21 | — | — | JP | claimed |
| WO-1999050358-A1 | PHOTOSENSITIZER FOR APPLICATIONS IN SOLAR TECHNOLOGY, METHOD FOR THE PRODUCTION THEREOF AND CONFIGURATION TO IMPLEMENT THE METHOD | HAHN-MEITNER-INSTITUT BERLIN GMBH (DE) | 1999-10-07 | — | — | WO | claimed |
| EP-0861026-A1 | SYNERGISTIC HERBICIDAL MIXTURES CONTAINING CYCLOHEXENONE OXIME ETHER | BASF AKTIENGESELLSCHAFT (DE) | 1998-09-02 | — | — | EP | claimed |
| WO-1997010710-A1 | SYNERGISTIC HERBICIDAL MIXTURES CONTAINING CYCLOHEXENONE OXIME ETHER | BASF AKTIENGESELLSCHAFT (DE) | 1997-03-27 | — | — | WO | claimed |
| CN-1076585-A | Synergistic herbicides and safeners | HOECHST AG (DE) | 1993-09-29 | — | — | CN | claimed |
| EP-0072475-B1 | CARBAMIC ESTERS, PREPARATION THEREOF, PESTICIDAL COMPOSITIONS ON THE BASIS OF THESE COMPOUNDS AND THEIR USE IN COMBATING PESTS | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1986-08-20 | — | — | EP | claimed |
| WO-2024140055-A1 | HIGH-TEMPERATURE-RESISTANT HYPERBRANCHED RETARDER FOR CONCRETE AND PREPARATION METHOD THEREFOR | 科之杰新材料集团有限公司 | 2024-07-04 | — | — | WO | disclosed |
| US-11970441-B2 | Method for preparing thionocarbamate and co-producing 2-mercaptoethanol or O-alkylthioethyl xanthate | CENTRAL SOUTH UNIVERSITY (CN) | 2024-04-30 | — | — | US | disclosed |
| US-4098888-A | THIAZOLYLACETAMIDO CEPHALOSPORIN TYPE COMPOUNDS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1978-07-04 | — | — | US | disclosed |
| US-4022686-A | BENZOTRIAZOLE | SUMITOMO METAL MINING CO., LIMITED (JA) | 1977-05-10 | — | — | US | disclosed |
| US-3975264-A | REACTION PRODUCT OF ALKALI METAL ISOPROPYL XANTHATE WITH ALKYLAMINE AS COLLECTOR | MINEREC CORPORATION (US) | 1976-08-17 | — | — | US | disclosed |