⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5352877 | 0.98 | TRPA1 (1.00) | — | |
| SCHEMBL3123984 | 0.98 | TRPA1 (1.00) | — | |
| SCHEMBL3115548 | 0.98 | TRPA1 (1.00) | — | |
| SCHEMBL1020887 | 0.98 | TRPA1 (1.00) | — | |
| SCHEMBL2679812 | 0.98 | TRPA1 (1.00) | — | |
| SCHEMBL25332310 | 0.98 | TRPA1 (1.00) | — | |
| SCHEMBL668271 | 0.93 | — | — | |
| Erucin SCHEMBL7579439 | 0.82 | TRPA1 (0.68) | — | |
| SCHEMBL10585683 | 0.82 | — | — | |
| SCHEMBL28836397 | 0.80 | TRPA1 (0.67) | — |
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 179 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020021544-A1 | CANNABIDIOL AND METHYLTHIO-BUTYL-ISOTHIOCYANATE FOR TREATING INFLAMMATORY DISEASES | BOL PHARMA LTD. (IL) | 2020-01-30 | — | — | WO | claimed |
| US-20120208879-A1 | METHODS AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING PSORIASIS | GAVISH-GALILEE BIO APPLICATIONS LTD. (IL) | 2012-08-16 | — | — | US | claimed |
| US-8158161-B2 | Methods and pharmaceutical compositions useful for treating psoriasis | S.U.L.V.E. LTD. (IL) | 2012-04-17 | — | — | US | claimed |
| US-20100260737-A1 | COMBINATION BETWEEN AN ISOTHIOCYANATE AND LEVODOPA FOR PARKINSON'S DISEASE TREATMENT | ALMA MATER STUDIORUM - UNIVERSITA' DI BOLOGNA (IT) | 2010-10-14 | — | — | US | claimed |
| EP-2229166-A1 | COMBINATION BETWEEN AN ISOTHIOCYANATE AND LEVODOPA FOR PARKINSON'S DISEASE TREATMENT | Alma Mater Studiorum - Università di Bologna (IT) | 2010-09-22 | — | — | EP | 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 |
| WO-2010001096-A2 | TREATMENT | PROVEXIS NATURAL PRODUCTS LIMITED (GB) | 2010-01-07 | — | — | WO | claimed |
| WO-2009083871-A1 | COMBINATION BETWEEN AN ISOTHIOCYANATE AND LEVODOPA FOR PARKINSON'S DISEASE TREATMENT | ALMA MATER STUDIORUM - UNIVERSITA' DI BOLOGNA (IT) | 2009-07-09 | — | — | WO | claimed |
| US-20080044497-A1 | Methods and Pharmaceutical Compositions Useful for Treating Psoriasis | S.U.L.V.E. LTD. (IL) | 2008-02-21 | — | — | US | claimed |
| EP-1841320-A2 | METHODS AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING PSORIASIS | S.U.L.V.E. Ltd. (IL) | 2007-10-10 | — | — | EP | claimed |
| WO-2006075330-A2 | METHODS AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING PSORIASIS | S.U.L.V.E. LTD. (IL) | 2006-07-20 | — | — | WO | claimed |
| WO-2002087388-A1 | CONTAINER FOR CLEANING IMPLEMENTS, IN ADDITION TO AN INSERTION BODY, TOOTHBRUSH AND RESERVOIR | NEUFELD KLAUS (AT) | 2002-11-07 | — | — | WO | claimed |
| US-12590057-B2 | Crystalline complexes | Theracryf PLC (GB) | 2026-03-31 | — | — | US | disclosed |
| US-12507698-B2 | Use of an extract of part of a rocket plant for stimulating the defenses of plants and trees and associated composition and method | ELICIR (FR) | 2025-12-30 | — | — | US | disclosed |
| US-20250197898-A1 | ISOTHIOCYANATE CONTAINING BRASSICACEAE PRODUCTS AND METHOD OF PREPARATION THEREOF | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 2025-06-19 | — | — | US | disclosed |
| WO-2025069039-A1 | AN IN SITU PROCESS FOR THE PREPARATION OF PRIMARY AMINE COMPOUNDS | SAMANT RAJARAM (IN) | 2025-04-03 | — | — | WO | disclosed |
| US-5411986-A | Chemoprotective isothiocyanates | THE JOHNS HOPKINS UNIVERSITY (US) | 1995-05-02 | — | — | US | disclosed |
| WO-1994019948-A9 | CHEMOPROTECTIVE ISOTHIOCYANATES | — | 1994-11-10 | — | — | WO | disclosed |
| WO-1994019948-A1 | CHEMOPROTECTIVE ISOTHIOCYANATES | CHO CHEON GYU (US) | 1994-09-15 | — | — | WO | disclosed |
| US-3932318-A | COPOLYMERS WITH ISOCYANATES, CRYOGENIC POLYMERIZATION, NONFLAMMABLE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-01-13 | — | — | US | disclosed |