⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11056256 | 0.76 | — | — | |
| SCHEMBL5693178 | 0.74 | HSD17B10 (0.35) | — | |
| SCHEMBL8726034 | 0.74 | TSHR (0.42) | — | |
| SCHEMBL28520802 | 0.74 | TSHR (0.42) | — | |
| SCHEMBL16309528 | 0.73 | — | — | |
| SCHEMBL6471616 | 0.72 | TSHR (0.48) | — | |
| SCHEMBL16731370 | 0.71 | — | — | |
| SCHEMBL15275825 | 0.71 | — | — | |
| SCHEMBL11519651 | 0.71 | — | — | |
| Isobutane SCHEMBL9578989 | 0.71 | ALDH1A1 (0.36) | — |
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 434 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120058637-A | Preparation method of unsaturated ketone and catalyst used in preparation method | 山东新和成精化科技有限公司 | 2025-05-30 | — | — | CN | claimed |
| CN-116462578-B | Method for synthesizing delta-methyl ketone by one-pot method | 万华化学集团股份有限公司 | 2024-04-09 | — | — | CN | claimed |
| CN-116462578-A | Method for synthesizing delta-methyl ketone by one-pot method | 万华化学集团股份有限公司 | 2023-07-21 | — | — | CN | claimed |
| CN-116272690-A | Synthesis method of unsaturated ketone | 山东新和成维生素有限公司 | 2023-06-23 | — | — | CN | claimed |
| CN-116272689-A | Method for continuously preparing unsaturated ketone | 山东新和成维生素有限公司 | 2023-06-23 | — | — | CN | claimed |
| CN-111039769-B | Method for synthesizing methyl heptenone from methyl butynol | 万华化学集团股份有限公司（CN） | 2023-01-13 | — | — | CN | claimed |
| CN-109534977-B | Method for synthesizing alpha, gamma-unsaturated dienone from propargyl alcohol and catalyst used in method | 万华化学集团股份有限公司 | 2022-04-22 | — | — | CN | claimed |
| CN-111039769-A | Method for synthesizing methylheptenone from methylbutynol | 万华化学集团股份有限公司 | 2020-04-21 | — | — | CN | claimed |
| CN-109534977-A | One kind synthesizing α, γ-unsaturation dienone method and the catalyst for this method by propargyl alcohol | 万华化学集团股份有限公司 | 2019-03-29 | — | — | CN | claimed |
| US-4642132-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1987-02-10 | — | — | US | claimed |
| EP-4711434-A1 | REFRIGERANT CYCLE APPARATUS | Daikin Industries, Ltd. (JP) | 2026-03-18 | — | — | EP | disclosed |
| EP-4234293-B1 | REFRIGERATION CYCLE DEVICE FOR VEHICLE | DAIKIN IND LTD (JP) | 2025-12-24 | — | — | EP | disclosed |
| US-12441922-B2 | Refrigerant-containing composition, use of same, refrigerator having same, operation method for said refrigerator, and refrigeration cycle device equipped with same | DAIKIN INDUSTRIES, LTD. (JP) | 2025-10-14 | — | — | US | disclosed |
| CN-120058637-A | Preparation method of unsaturated ketone and catalyst used in preparation method | 山东新和成精化科技有限公司 | 2025-05-30 | — | — | CN | disclosed |
| US-20250115796-A1 | REFRIGERATION CYCLE APPARATUS | DAIKIN INDUSTRIES, LTD. (JP) | 2025-04-10 | — | — | US | disclosed |
| EP-0133454-B1 | DERIVATIVES OF CARBOXYSILOXANES AND THEIR USE AS INTERNAL MOLD RELEASE AGENTS | THE DOW CHEMICAL COMPANY (US) | 1987-08-26 | — | — | EP | disclosed |
| US-4642132-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1987-02-10 | — | — | US | disclosed |
| EP-0133454-A1 | Derivatives of carboxysiloxanes and their use as internal mold release agents | THE DOW CHEMICAL COMPANY (US) | 1985-02-27 | — | — | EP | disclosed |
| US-4472341-A | REACTION INJECTION MOLDING | THE UPJOHN COMPANY (US) | 1984-09-18 | — | — | US | disclosed |
| US-4115545-A | Pharmaceutical composition containing prostadienoic acid for regulating gastric secretion | ALZA CORPORATION (US) | 1978-09-19 | — | — | US | disclosed |