⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL276971 | 0.79 | — | — | |
| SCHEMBL12417959 | 0.69 | — | — | |
| SCHEMBL276087 | 0.69 | — | — | |
| SCHEMBL8824096 | 0.67 | — | — | |
| SCHEMBL952833 | 0.67 | — | — | |
| SCHEMBL5376891 | 0.67 | — | — | |
| SCHEMBL8983655 | 0.67 | — | — | |
| SCHEMBL277523 | 0.67 | ALDH1A1 (0.35) | — | |
| SCHEMBL20978418 | 0.67 | — | — | |
| SCHEMBL20978444 | 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 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0195053-A1 | PROCESS FOR PREPARING 1,3-CYCLOHEXANEDIONE DERIVATIVES AND INTERMEDIATES THEREFOR. | CHEVRON RES & TECH (US) | 1986-09-24 | — | — | EP | claimed |
| WO-1986002065-A1 | PROCESS FOR PREPARING 1,3-CYCLOHEXANEDIONE DERIVATIVES AND INTERMEDIATES THEREFOR | CHEVRON RESEARCH COMPANY (US) | 1986-04-10 | — | — | WO | claimed |
| CN-115286500-B | Preparation method and composition of acetoacetic acid, 6-ethylthio-3-hepten-2-one and intermediate thereof | 山东新和成氨基酸有限公司 | 2025-03-25 | — | — | CN | disclosed |
| CN-112236421-B | Pyrazole derivatives and pest control agents | 组合化学工业株式会社 | 2023-12-26 | — | — | CN | disclosed |
| CN-117024321-A | Total synthesis method of clethodim | 首建科技有限公司 | 2023-11-10 | — | — | CN | disclosed |
| CN-115286500-A | Preparation method and composition of acetoacetic acid, 6-ethylthio-3-heptylene-2-ketone and intermediate thereof | 山东新和成氨基酸有限公司 | 2022-11-04 | — | — | CN | disclosed |
| CN-111250027-B | Drug intermediate reaction tube and production line | 内蒙古兰格生物科技有限公司 | 2022-03-11 | — | — | CN | disclosed |
| CN-211886858-U | Drug intermediate production equipment and production line | 内蒙古兰格生物科技有限公司 | 2020-11-10 | — | — | CN | disclosed |
| CN-111250027-A | Drug intermediate reaction tube and production line | 内蒙古兰格生物科技有限公司 | 2020-06-09 | — | — | CN | disclosed |
| EP-1713786-B1 | 1-(AZOLIN-2-YL) AMINO-1,2-DIPHENYLETHANE COMPOUNDS FOR COMBATTING INSECTS, ARACHNIDS AND NEMATODES | BASF SE (DE) | 2012-08-08 | — | — | EP | disclosed |
| US-8134013-B2 | Amide compound and thrombopoietin receptor activator | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2012-03-13 | — | — | US | disclosed |
| EP-0668852-A1 | SUBSTITUTED ORTHO-ETHENYL-PHENYL ACETIC ACID DERIVATIVES | BASF Aktiengesellschaft (DE) | 1995-08-30 | — | — | EP | disclosed |
| US-5416068-A | Alpha-phenylacrylic acid derivatives, their preparation and their use for controlling pests and harmful fungi | BASF AKTIENGESELLSCHAFT (DE) | 1995-05-16 | — | — | US | disclosed |
| WO-1994019331-A1 | ORTHO-SUBSTITUTED 2-METHOXYIMINOPHENYLACETIC ACID METHYLAMIDES | BASF AKTIENGESELLSCHAFT (DE) | 1994-09-01 | — | — | WO | disclosed |
| WO-1994011334-A1 | SUBSTITUTED ORTHO-ETHENYL-PHENYL ACETIC ACID DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 1994-05-26 | — | — | WO | disclosed |
| US-5298527-A | Insecticides | BASF AKTIENGESELLSCHAFT (DE) | 1994-03-29 | — | — | US | disclosed |
| EP-0513580-A2 | Alpha-phenyl-acrylic acid derivatives, process for their preparation and their use as parasiticides and fungicides | BASF Aktiengesellschaft (DE) | 1992-11-19 | — | — | EP | disclosed |
| EP-0454863-A1 | METHOD FOR THE PREPARATION OF BETA-HYDROXYKETONES. | NIPPON SODA CO (JP) | 1991-11-06 | — | — | EP | disclosed |
| WO-1991007369-A1 | METHOD FOR THE PREPARATION OF β-HYDROXYKETONES | NIPPON SODA CO., LTD. (JP) | 1991-05-30 | — | — | WO | disclosed |
| EP-0145551-B1 | PROCESS FOR THE PREPARATION OF ALPHA, BETA-UNSATURATED KETONES | EASTMAN KODAK COMPANY (a New Jersey corporation) (US) | 1987-08-26 | — | — | EP | disclosed |