⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6932498 | 1.00 | — | — | |
| SCHEMBL21637609 | 1.00 | — | — | |
| SCHEMBL29034685 | 0.82 | — | — | |
| SCHEMBL625852 | 0.82 | — | — | |
| SCHEMBL7164679 | 0.82 | — | — | |
| SCHEMBL11263667 | 0.78 | ALDH1A1 (0.58) | — | |
| SCHEMBL11263673 | 0.78 | ALDH1A1 (0.58) | — | |
| SCHEMBL701761 | 0.76 | — | — | |
| SCHEMBL701762 | 0.76 | — | — | |
| SCHEMBL100572 | 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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118156622-A | Lithium ion battery and power utilization device | 惠州锂威新能源科技有限公司 | 2024-06-07 | — | — | CN | claimed |
| CN-115704808-A | Headspace solid phase microextraction-gas chromatography mass spectrometry detection and analysis method | 丰益(上海)生物技术研发中心有限公司 | 2023-02-17 | — | — | CN | claimed |
| CN-118156622-A | Lithium ion battery and power utilization device | 惠州锂威新能源科技有限公司 | 2024-06-07 | — | — | CN | disclosed |
| CN-115704808-A | Headspace solid phase microextraction-gas chromatography mass spectrometry detection and analysis method | 丰益(上海)生物技术研发中心有限公司 | 2023-02-17 | — | — | CN | disclosed |
| EP-4134135-A1 | RAPESEED MEAL HYDROLYSATE, METHOD FOR PREPARING SAME AND USE THEREOF IN A FOOD PRODUCT AND IN COSMETICS, IN PARTICULAR FOR TREATING SKIN AGEING AND FOR SKIN DEPIGMENTATION | Lyster (FR) | 2023-02-15 | — | — | EP | disclosed |
| US-9328127-B2 | System for controlling the reactivity of boronic acids | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2016-05-03 | — | — | US | disclosed |
| EP-2181103-B1 | SYSTEM FOR CONTROLLING THE REACTIVITY OF BORONIC ACIDS | UNIV ILLINOIS (US) | 2015-08-05 | — | — | EP | disclosed |
| US-20130296573-A1 | System for Controlling the Reactivity of Boronic Acids | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2013-11-07 | — | — | US | disclosed |
| EP-0897130-B1 | Thermographic recording element | FUJIFILM CORP (JP) | 2009-07-15 | — | — | EP | disclosed |
| EP-1212294-B1 | PROCESS FOR THE CONVERSION OF ALDEHYDES INTO NITRILES USING AMMONIA AND HYDROGEN PEROXIDE | MILLENNIUM SPECIALTY CHEM INC (US) | 2003-12-10 | — | — | EP | disclosed |
| US-6114565-A | Process for obtaining nitriles | MILLENNIUM SPECIALTY CHEMICALS (US) | 2000-09-05 | — | — | US | disclosed |
| WO-1996038388-A1 | USE OF FLUIDIZED BED REACTORS FOR TREATMENT OF WASTES CONTAINING ORGANIC NITROGEN COMPOUNDS | MONSANTO COMPANY (US) | 1996-12-05 | — | — | WO | disclosed |
| US-5540840-A | Use of fluidized bed reactors for treatment of wastes containing organic nitrogen compounds | MONSANTO COMPANY (US) | 1996-07-30 | — | — | US | disclosed |
| EP-0267438-B1 | PROCESS FOR THE PREPARATION OF UNSATURATED NITRILES | BASF Aktiengesellschaft (DE) | 1991-10-16 | — | — | EP | disclosed |
| US-4904812-A | Preparation of unsaturated nitriles | BASF AKTIENGESELLSCHAFT (DE) | 1990-02-27 | — | — | US | disclosed |
| EP-0267438-A2 | Process for the preparation of unsaturated nitriles | BASF Aktiengesellschaft (DE) | 1988-05-18 | — | — | EP | disclosed |
| US-4510099-A | Process for preparing pure diacetonitrile | CHEMIE LINZ AKTIENGESELLSCHAFT (AT) | 1985-04-09 | — | — | US | disclosed |