⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL109114 | 1.00 | — | — | |
| SCHEMBL29137677 | 1.00 | TDP1 (0.43) | — | |
| SCHEMBL7939021 | 1.00 | — | — | |
| SCHEMBL17378384 | 0.84 | TET2 (0.35) | — | |
| SCHEMBL105176 | 0.83 | — | — | |
| SCHEMBL18610931 | 0.83 | — | — | |
| SCHEMBL7595851 | 0.83 | — | — | |
| SCHEMBL1784083 | 0.83 | TSHR (0.42) | — | |
| SCHEMBL1785261 | 0.81 | GPR84 (0.64) | — | |
| SCHEMBL9059036 | 0.81 | GPR84 (0.64) | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6245328-B1 | USING MIXTURE CONTAINING STEREOISOMER OF 3-HYDROXYHEXAN-2-ONE AND TWO STEREOISOMERS OF HEXANE-2,3-DIOL | BASF AKTIENGESELLSCHAFT (DE) | 2001-06-12 | — | — | US | claimed |
| EP-0789512-A1 | MIXTURES AND AGENTS SUITABLE FOR COMBATTING HYLOTRUPES BAJULUS AND PYRRHIDIUM SANGUINEUM | BASF AKTIENGESELLSCHAFT (DE) | 1997-08-20 | — | — | EP | claimed |
| WO-1996013976-A1 | MIXTURES AND AGENTS SUITABLE FOR COMBATTING HYLOTRUPES BAJULUS AND PYRRHIDIUM SANGUINEUM | BASF AKTIENGESELLSCHAFT (DE) | 1996-05-17 | — | — | WO | claimed |
| JP-8291003-A | — | — | None | — | — | JP | disclosed |
| CN-112679325-B | Preparation method of longicorn sex pheromone 2, 3-diketone series compounds and derivatives thereof | 华南农业大学 | 2022-09-30 | — | — | CN | disclosed |
| CN-112679325-A | Preparation method of longicorn sex pheromone 2, 3-diketone series compounds and derivatives thereof | 华南农业大学 | 2021-04-20 | — | — | CN | disclosed |
| US-20170066783-A1 | Aryl, Heteroaryl, and Heterocyclic Compounds for Treatment of Medical Disorders | ACHILLION PHARMACEUTICALS, INC. (US) | 2017-03-09 | — | — | US | disclosed |
| CN-103798206-B | The method of modified interception baffle-type Longicorn trap and monitoring and control longicorn | NORTHEAST FORESTRY UNIVERSITY (CN) | 2016-03-02 | — | — | CN | disclosed |
| CN-203723304-U | Anoplophora glabripennis motsch trap | UNIV NORTHEAST FORESTRY | 2014-07-23 | — | — | CN | disclosed |
| CN-103798206-A | Improved intercepting baffle type longicorn trapper and method for monitoring and controlling longicorn using improved intercepting baffle type longicorn trapper | UNIV NORTHEAST FORESTRY | 2014-05-21 | — | — | CN | disclosed |
| US-8535689-B2 | Identification of bacterial autoinducer and use in treating bacterial pathogenicity | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2013-09-17 | — | — | US | disclosed |
| US-20100273890-A1 | IDENTIFICATION OF BACTERIAL AUTOINDUCER AND USE IN TREATING BACTERIAL PATHOGENICITY | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2010-10-28 | — | — | US | disclosed |
| US-6245328-B1 | USING MIXTURE CONTAINING STEREOISOMER OF 3-HYDROXYHEXAN-2-ONE AND TWO STEREOISOMERS OF HEXANE-2,3-DIOL | BASF AKTIENGESELLSCHAFT (DE) | 2001-06-12 | — | — | US | disclosed |
| US-6245328-B1 | USING MIXTURE CONTAINING STEREOISOMER OF 3-HYDROXYHEXAN-2-ONE AND TWO STEREOISOMERS OF HEXANE-2,3-DIOL | BASF AKTIENGESELLSCHAFT (DE) | 2001-06-12 | — | — | US | disclosed |
| EP-0789512-B1 | MIXTURES AND AGENTS SUITABLE FOR COMBATTING HYLOTRUPES BAJULUS AND PYRRHIDIUM SANGUINEUM | BASF AG (DE) | 1999-01-07 | — | — | EP | disclosed |
| EP-0789512-A1 | MIXTURES AND AGENTS SUITABLE FOR COMBATTING HYLOTRUPES BAJULUS AND PYRRHIDIUM SANGUINEUM | BASF AKTIENGESELLSCHAFT (DE) | 1997-08-20 | — | — | EP | disclosed |
| EP-0789512-A1 | MIXTURES AND AGENTS SUITABLE FOR COMBATTING HYLOTRUPES BAJULUS AND PYRRHIDIUM SANGUINEUM | BASF AKTIENGESELLSCHAFT (DE) | 1997-08-20 | — | — | EP | disclosed |
| JP-H08291003-A | SEX ATTRACTANT OF ANAGLYPTUS SUBFASCIANTUS | NORIN SUISANSYO SANSHI KONCHU NOGYO GIJUTSU KENKYUSHO | 1996-11-05 | — | — | JP | disclosed |
| WO-1996013976-A1 | MIXTURES AND AGENTS SUITABLE FOR COMBATTING HYLOTRUPES BAJULUS AND PYRRHIDIUM SANGUINEUM | BASF AKTIENGESELLSCHAFT (DE) | 1996-05-17 | — | — | WO | disclosed |
| WO-1996013976-A1 | MIXTURES AND AGENTS SUITABLE FOR COMBATTING HYLOTRUPES BAJULUS AND PYRRHIDIUM SANGUINEUM | BASF AKTIENGESELLSCHAFT (DE) | 1996-05-17 | — | — | WO | disclosed |