⚠ 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 | |
|---|---|---|---|---|
| Isopropyl Isothiocyanate SCHEMBL28808742 | 0.93 | — | — | |
| Isopropyl Isothiocyanate SCHEMBL28808741 | 0.87 | — | — | |
| SCHEMBL2134253 | 0.77 | — | — | |
| Isopropyl Isothiocyanate SCHEMBL20183963 | 0.75 | TRPA1 (0.56) | — | |
| SCHEMBL28220625 | 0.74 | — | — | |
| Butyl Isothiocyanate SCHEMBL18154858 | 0.74 | NAAA (0.59) | — | |
| SCHEMBL11424714 | 0.72 | TRPA1 (0.56) | — | |
| SCHEMBL944822 | 0.72 | — | — | |
| SCHEMBL1024887 | 0.72 | — | — | |
| SCHEMBL7808164 | 0.72 | — | — |
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 1113 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-122094572-A | Novel feed additive composition | — | 2026-05-26 | — | — | CN | claimed |
| EP-4444108-B1 | ALDEHYDE MIXTURES FOR FLAVOUR IMPROVEMENT | SYMRISE AG (DE) | 2025-09-10 | — | — | EP | claimed |
| US-12402638-B2 | Materials and methods for extending shelf-life of foods | JP LABORATORIES, INC. (US) | 2025-09-02 | — | — | US | claimed |
| US-20250194617-A1 | Materials and Methods for Extending Shelf-Life of Foods | JP LABORATORIES, INC. | 2025-06-19 | — | — | US | claimed |
| US-20250169514-A1 | Materials and Methods for Extending Shelf-Life of Foods | JP LABORATORIES, INC. | 2025-05-29 | — | — | US | claimed |
| US-20250160275-A1 | COMPOUNDS FOR MODIFYING MEIOTIC RECOMBINATION AND METHODS RELATING THERETO | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL | 2025-05-22 | — | — | US | claimed |
| CN-119924491-A | Flavoring composition with balanced taste characteristics | 西姆莱斯有限公司 | 2025-05-06 | — | — | CN | claimed |
| WO-2025088629-A1 | A NOVEL FEED-ADDITIVE COMPOSITION | KYNTOX BIOTECH INDIA PRIVATE LIMITED (IN) | 2025-05-01 | — | — | WO | claimed |
| CN-116103493-B | Method for recycling copper and zinc in refractory gold concentrate pickle liquor | 烟台市金奥环保科技有限公司 | 2025-03-21 | — | — | CN | claimed |
| US-20250084759-A1 | FLUORESCENT DYE OIL TRACER COMPOSITIONS | SAUDI ARABIAN OIL COMPANY (SA) | 2025-03-13 | — | — | US | claimed |
| CN-104117064-A | Combined application of isothiocyanate compound and hormone medicine | WUXI JC PHARMACAUTICAL TECHNOLOGY INC | 2014-10-29 | — | — | CN | claimed |
| US-20130203715-A1 | USE OF TRP CHANNEL AGONISTS TO TREAT INFECTIONS | PULMATRIX, INC. (US) | 2013-08-08 | — | — | US | claimed |
| WO-2012012498-A9 | USE OF TRP CHANNEL AGONISTS TO TREAT INFECTIONS | PULMATRIX, INC. (US) | 2012-04-05 | — | — | WO | claimed |
| WO-2012012498-A2 | USE OF TRP CHANNEL AGONISTS TO TREAT INFECTIONS | PULMATRIX, INC. (US) | 2012-01-26 | — | — | WO | claimed |
| WO-2010065329-A2 | NANOPARTICLES FOR CANCER TREATMENT | THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2010-06-10 | — | — | WO | claimed |
| EP-2163238-A2 | Compound for lightening skin tone comprising sulforaphane or sulforaphene or their derivates | Henkel AG & Co. KGaA (DE) | 2010-03-17 | — | — | EP | claimed |
| US-20060241178-A1 | Compositions and methods for treating lung cancer | IMMUNEGUARD LLC (US) | 2006-10-26 | — | — | US | claimed |
| EP-1581259-A1 | METHOD AND MATERIAL FOR SPECIFIC PROLIFERATION PROMOTION OF LYMPHOCYTE SUB-POPULATIONS BY MEANS OF A COMBINATION OF AN IMMUNOMODULATOR WITH A NON-WATER-SOLUBLE NATURAL PRODUCT AND A CARRIER | Gradl-Grams, Marianne (DE) | 2005-10-05 | — | — | EP | claimed |
| WO-2004060402-A1 | METHOD AND MATERIAL FOR SPECIFIC PROLIFERATION PROMOTION OF LYMPHOCYTE SUB-POPULATIONS BY MEANS OF A COMBINATION OF AN IMMUNOMODULATOR WITH A NON-WATER-SOLUBLE NATURAL PRODUCT AND A CARRIER | GRADL-GRAMS, MARIANNE (DE) | 2004-07-22 | — | — | WO | claimed |
| WO-2004060365-A1 | COMPOSITIONS AND METHODS FOR TREATING LUNG CANCER | AMERICAN HEALTH FOUNDATION (US) | 2004-07-22 | — | — | WO | claimed |