⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20942891 | 1.00 | — | — | |
| SCHEMBL11058596 | 1.00 | — | — | |
| SCHEMBL9805751 | 0.78 | — | — | |
| SCHEMBL11650137 | 0.75 | — | — | |
| SCHEMBL11650139 | 0.75 | — | — | |
| SCHEMBL8605047 | 0.74 | ALDH1A1 (0.60) | — | |
| SCHEMBL18676231 | 0.74 | — | — | |
| SCHEMBL8605046 | 0.74 | ALDH1A1 (0.60) | — | |
| SCHEMBL254156 | 0.72 | TRPA1 (0.42) | — | |
| SCHEMBL16192692 | 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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0244632-B1 | TUBE BUNDLE REACTOR, ITS USE IN EXOTHERMAL ORGANIC REACTIONS AND PROCESS FOR THE PREPARATION OF KETONES AND ALDEHYDES | BASF Aktiengesellschaft (DE) | 1991-02-20 | — | — | EP | claimed |
| EP-0244632-A2 | Tube bundle reactor, its use in exothermal organic reactions and process for the preparation of ketones and aldehydes | BASF Aktiengesellschaft (DE) | 1987-11-11 | — | — | EP | claimed |
| EP-0055354-B1 | PROCESS FOR THE CONTINUOUS PREPARATION OF 2-ALKYL-BUTEN-1-ALS | BASF Aktiengesellschaft (DE) | 1984-09-12 | — | — | EP | claimed |
| US-4440960-A | FROM CORRESPONDING ALCOHOLS BY OXIDATIVE DEHYDROGENATION | BASF AKTIENGESELLSCHAFT (DE) | 1984-04-03 | — | — | US | claimed |
| EP-0055354-A1 | Process for the continuous preparation of 2-alkyl-buten-1-als | BASF Aktiengesellschaft (DE) | 1982-07-07 | — | — | EP | claimed |
| US-4165342-A | BY OXIDATIVE DEHYDROGENATION OF THE ALCOHOL, LAYERS OF SILVER AND COPPER CATALYST CRYSTALS | BASF AKTIENGESELLSCHAFT (DE) | 1979-08-21 | — | — | US | claimed |
| CN-109310982-B | Composition for removing sulfur-containing compounds | 株式会社可乐丽（JP） | 2023-01-13 | — | — | CN | disclosed |
| US-11291947-B2 | Composition for removing sulfur-containing compound | KURARAY CO., LTD. (JP) | 2022-04-05 | — | — | US | disclosed |
| US-20190329175-A1 | COMPOSITION FOR REMOVING SULFUR-CONTAINING COMPOUND | KURARAY CO., LTD. (JP) | 2019-10-31 | — | — | US | disclosed |
| EP-3476478-A1 | COMPOSITION FOR REMOVING SULFUR-CONTAINING COMPOUND | Kuraray Co., Ltd. (JP) | 2019-05-01 | — | — | EP | disclosed |
| CN-105664959-B | Unsaturated acids catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2018-05-11 | — | — | CN | disclosed |
| CN-104107696-B | The preparation method of prepared by acrolein oxidation acrylic acid catalyst | 中国石油化工股份有限公司 | 2017-09-15 | — | — | CN | disclosed |
| CN-102186549-A | Process for recovering carboxylic acid from dilute aqueous streams | ARKEMA INC | 2011-09-14 | — | — | CN | disclosed |
| EP-0055354-A1 | Process for the continuous preparation of 2-alkyl-buten-1-als | BASF Aktiengesellschaft (DE) | 1982-07-07 | — | — | EP | disclosed |
| EP-0055354-A1 | Process for the continuous preparation of 2-alkyl-buten-1-als | BASF Aktiengesellschaft (DE) | 1982-07-07 | — | — | EP | disclosed |
| EP-0055354-A1 | Process for the continuous preparation of 2-alkyl-buten-1-als | BASF Aktiengesellschaft (DE) | 1982-07-07 | — | — | EP | disclosed |
| EP-0047412-A1 | Pyrazines, their preparation and pharmaceutical compositions containing them | Dr. Karl Thomae GmbH (DE) | 1982-03-17 | — | — | EP | disclosed |
| US-4165342-A | BY OXIDATIVE DEHYDROGENATION OF THE ALCOHOL, LAYERS OF SILVER AND COPPER CATALYST CRYSTALS | BASF AKTIENGESELLSCHAFT (DE) | 1979-08-21 | — | — | US | disclosed |
| US-4165342-A | BY OXIDATIVE DEHYDROGENATION OF THE ALCOHOL, LAYERS OF SILVER AND COPPER CATALYST CRYSTALS | BASF AKTIENGESELLSCHAFT (DE) | 1979-08-21 | — | — | US | disclosed |
| US-4165342-A | BY OXIDATIVE DEHYDROGENATION OF THE ALCOHOL, LAYERS OF SILVER AND COPPER CATALYST CRYSTALS | BASF AKTIENGESELLSCHAFT (DE) | 1979-08-21 | — | — | US | disclosed |