⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4819264 | 1.00 | — | — | |
| SCHEMBL11971993 | 1.00 | — | — | |
| Methyl Alcohol SCHEMBL16568696 | 0.95 | — | — | |
| Formaldehyde SCHEMBL27818408 | 0.93 | — | — | |
| Acetaldehyde SCHEMBL11445720 | 0.89 | — | — | |
| SCHEMBL27946314 | 0.81 | ALDH1A1 (0.38) | — | |
| SCHEMBL11650269 | 0.76 | — | — | |
| SCHEMBL11433423 | 0.75 | — | — | |
| SCHEMBL3643635 | 0.74 | — | — | |
| 3-Octanone SCHEMBL28192905 | 0.74 | KMT2A (0.34) | — |
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 202 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112920032-B | Preparation method of beta-isophorone | 万华化学集团股份有限公司 | 2022-07-12 | — | — | CN | claimed |
| CN-106083682-B | A kind of preparation method of the carotenal of β Apos 8 ' | 广州巨元生化有限公司 | 2017-10-27 | — | — | CN | claimed |
| CN-106083682-A | A kind of preparation method of β apo-8 ' carotenal | 广州巨元生化有限公司 | 2016-11-09 | — | — | CN | claimed |
| CN-101460064-A | Carotenoid-containing dietary supplement | CHEMAPHOR INC (CA) | 2009-06-17 | — | — | CN | claimed |
| EP-2007221-A1 | CAROTENOID-CONTAINING DIETARY SUPPLEMENT | Chemaphor Inc. (CA) | 2008-12-31 | — | — | EP | claimed |
| WO-2007112587-A1 | CAROTENOID-CONTAINING DIETARY SUPPLEMENT | CHEMAPHOR INC. (CA) | 2007-10-11 | — | — | WO | claimed |
| WO-2003071425-A2 | PROCESS FOR THE PREPARATION OF 1-(2,6,6-TRIMETHYL-2-CYCLOHEXENE-1-YL)-BUT-2-ENE-1-ONE | VEMULKAR, NAGARAJ, NARAYANSWAMY (IN) | 2003-08-28 | — | — | WO | claimed |
| US-20030153790-A1 | Process for the preparation of 1-(2,6,6-trimethyl-2-cyclohexene-1-yl)-but-2-ene-1-one | VEMULKAR, RAVIKIRAN NAGARAJ (IN) | 2003-08-14 | — | — | US | claimed |
| US-6506917-B1 | Ligands which are more selective for retinoid X receptor than is retinoic acid | THE SALK INSTITUTE FOR BIOLOGICAL STUDIES | 2003-01-14 | — | — | US | claimed |
| WO-2001053301-A1 | CHIMERIC MOLECULES CONSISTING OF PSORALEN AND RETINOID, PREPARATION METHOD, USES THEREOF FOR TREATING CELL HYPERPROLIFERATION PATHOLOGIES AND IN PARTICULAR PSORIASIS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) | 2001-07-26 | — | — | WO | claimed |
| EP-0025572-B1 | DIALKOXY-PHOSPHONYL-N-ALKYL-FORMIC ACID AMIDES AND THEIR USE AS ADDITIVES DURING THE PREPARATION OF FLAME-COVERABLE AND HIGH-FREQUENCY WELDABLE POLYURETHANE FOAMS | BAYER AG (DE) | 1983-03-23 | — | — | EP | claimed |
| US-4297492-A | STABILIZERS FOR PLASTICS | CIBA-GEIGY CORPORATION (US) | 1981-10-27 | — | — | US | claimed |
| EP-0012436-A1 | Process for hydrogenation of 2,6,6-trimethyl cyclohexene derivatives, products produced thereby and organoleptic uses of said products | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1980-06-25 | — | — | EP | claimed |
| US-12582119-B2 | Formulation and composition which promote targeted pollination by bees towards kiwi crops and related methods | CONSEJO NACIONAL DE INVESTIGACIONES CIENTIFICAS Y TECNICAS (CONICET) (AR) | 2026-03-24 | — | — | US | disclosed |
| US-20260008997-A1 | CELL CULTURE COMPOSITIONS WITH ANTIOXIDANTS AND METHODS FOR POLYPEPTIDE PRODUCTION | GENENTECH, INC. (US) | 2026-01-08 | — | — | US | disclosed |
| US-20250381202-A1 | PRODRUG KIT FOR MULTI-PRONGED CHEMOTHERAPY | ZOUNEK ALEX (DE) | 2025-12-18 | — | — | US | disclosed |
| US-4292447-A | Process for hydrogenation of 2,6,6-trimethyl cyclohexene derivatives, products produced thereby and organoleptic uses of said products | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1981-09-29 | — | — | US | disclosed |
| US-4292447-A | Process for hydrogenation of 2,6,6-trimethyl cyclohexene derivatives, products produced thereby and organoleptic uses of said products | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1981-09-29 | — | — | US | disclosed |
| EP-0012436-A1 | Process for hydrogenation of 2,6,6-trimethyl cyclohexene derivatives, products produced thereby and organoleptic uses of said products | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1980-06-25 | — | — | EP | disclosed |
| US-4209450-A | Introduction of a carbonyl group into a cyclohexene ring | BASK AKTIENGESELLSCHAFT (DE) | 1980-06-24 | — | — | US | disclosed |