Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Acetone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Acetone SCHEMBL10591911 | 1.00 | ALDH1A1 (0.61) | — | |
| Acetone SCHEMBL16733018 | 0.96 | — | — | |
| Acetic Acid SCHEMBL2140076 | 0.89 | ALDH1A1 (0.57) | — | |
| Acetic Acid SCHEMBL28674854 | 0.89 | ALDH1A1 (0.57) | — | |
| Butanedione SCHEMBL28264623 | 0.89 | TSHR (0.57) | — | |
| Acetamide SCHEMBL9542290 | 0.89 | LMNA (0.57) | — | |
| Acetic Acid SCHEMBL5819601 | 0.89 | ALDH1A1 (0.57) | — | |
| Acetic Acid SCHEMBL11054868 | 0.89 | ALDH1A1 (0.57) | — | |
| Acetic Acid SCHEMBL503041 | 0.89 | — | — | |
| Acetamide SCHEMBL66201 | 0.89 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118027580-A | Thermo-oxidative aging resistant PVC (polyvinyl chloride) sizing material and preparation method thereof | 广东银豪塑胶制品有限公司 | 2024-05-14 | — | — | CN | claimed |
| CN-115948913-A | Antibacterial underwear knitted fabric and preparation method thereof | 浙江剑利美针织服饰有限公司 | 2023-04-11 | — | — | CN | claimed |
| WO-1997013148-A9 | METHOD FOR MEASURING FREE RADICAL CYTOTOXIC DEGRADATION | — | 1997-11-06 | — | — | WO | claimed |
| WO-1997013148-A1 | METHOD FOR MEASURING FREE RADICAL CYTOTOXIC DEGRADATION | STANINGER HILDEGARDE L A (US) | 1997-04-10 | — | — | WO | claimed |
| CN-118027580-A | Thermo-oxidative aging resistant PVC (polyvinyl chloride) sizing material and preparation method thereof | 广东银豪塑胶制品有限公司 | 2024-05-14 | — | — | CN | disclosed |
| CN-117736124-A | Solid form of naphthylamine mitochondrial autophagy inducer, preparation method, pharmaceutical composition and application thereof | 杭州天玑济世生物科技有限公司 | 2024-03-22 | — | — | CN | disclosed |
| CN-115948913-A | Antibacterial underwear knitted fabric and preparation method thereof | 浙江剑利美针织服饰有限公司 | 2023-04-11 | — | — | CN | disclosed |
| CN-110862508-B | Preparation method of triazine-based fluorine-containing chain extender modified polyurethane emulsion | 陕西科技大学 | 2021-07-13 | — | — | CN | disclosed |
| CN-110862508-A | Preparation method of triazine-based fluorine-containing chain extender modified polyurethane emulsion | 陕西科技大学 | 2020-03-06 | — | — | CN | disclosed |
| CN-107540607-A | The crystal habit of prolyl hydroxylase inhibitors | 菲布罗根有限公司 | 2018-01-05 | — | — | CN | disclosed |
| CN-107501177-A | The crystal habit of prolyl hydroxylase inhibitors | 菲布罗根有限公司 | 2017-12-22 | — | — | CN | disclosed |
| CN-107382859-A | The crystal habit of prolyl hydroxylase inhibitors | 菲布罗根有限公司 | 2017-11-24 | — | — | CN | disclosed |
| CN-107382860-A | The crystal habit of prolyl hydroxylase inhibitors | 菲布罗根有限公司 | 2017-11-24 | — | — | CN | disclosed |
| CN-103539735-B | Crystalline forms of prolyl hydroxylase inhibitors | 菲布罗根有限公司 | 2017-08-04 | — | — | CN | disclosed |
| CN-1166689-C | Purification method of hemoglobin | ض� | 2004-09-15 | — | — | CN | disclosed |
| CN-1482114-A | Method of hydrolyzing and cracking isopentenyl methylpentenes ketone for preparing methylheptanone | 中国石化上海石油化工股份有限公司 | 2004-03-17 | — | — | CN | disclosed |
| CN-1308636-A | Purification method of hemoglobin | BIOPURE CORP (US) | 2001-08-15 | — | — | CN | disclosed |