⚠ 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 SCHEMBL1603144 | 0.90 | — | — | |
| Acetone SCHEMBL18875610 | 0.90 | — | — | |
| Acetone SCHEMBL8091689 | 0.88 | — | — | |
| Acetone SCHEMBL625148 | 0.82 | — | — | |
| Acetone SCHEMBL626214 | 0.82 | — | — | |
| Acetone SCHEMBL19281749 | 0.82 | — | — | |
| Acetone SCHEMBL15253227 | 0.79 | — | — | |
| Acetone SCHEMBL30091178 | 0.77 | — | — | |
| Acetone SCHEMBL3859411 | 0.72 | — | — | |
| Acetone SCHEMBL304055 | 0.70 | — | — |
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
Appears in 8160 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12441669-B2 | PCNHCP metal complexes and uses thereof | TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) | 2025-10-14 | — | — | US | claimed |
| WO-2025041809-A1 | METHOD FOR PRODUCING DEUTERATED COMPOUND | 国立大学法人九州大学 | 2025-02-27 | — | — | WO | claimed |
| CN-119285486-A | Preparation method of atenolol-d 7 | 宁波萃英化学技术有限公司 | 2025-01-10 | — | — | CN | claimed |
| CN-118619811-A | Preparation method and purification method of tert-butyl alcohol-d 9 | 宁波萃英化学技术有限公司 | 2024-09-10 | — | — | CN | claimed |
| CN-118530089-A | Preparation method of tert-butyl alcohol-d 10 | 宁波萃英化学技术有限公司 | 2024-08-23 | — | — | CN | claimed |
| US-20230322647-A1 | PCNHCP METAL COMPLEXES AND USES THEREOF | TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) | 2023-10-12 | — | — | US | claimed |
| CN-114163487-B | Preparation method of stable isotope deuterium labeled D-fructose-1, 2,3,4,5-O-D5 | 上海化工研究院有限公司 | 2023-08-01 | — | — | CN | claimed |
| CN-109632859-B | Chiral micelle NMR-based chiral small molecule compound optical purity analysis method | 西安科技大学 | 2022-06-24 | — | — | CN | claimed |
| EP-3762732-B1 | METHOD FOR HETERONUCLEAR QUANTITATIVE DETERMINATION USING NMR-SPECTROSCOPY AND METHOD FOR DETERMINING THE DEGREE OF DEUTERATION OF A DEUTERATED COMPOUND | BRUKER BIOSPIN GMBH (DE) | 2022-05-04 | — | — | EP | claimed |
| CN-114163487-A | Preparation method of stable isotope deuterium-labeled D-fructose-1, 2,3,4,5-O-D5 | 上海化工研究院有限公司 | 2022-03-11 | — | — | CN | claimed |
| US-20220026380-A1 | NUCLEAR MAGNETIC RESONANCE IMPLEMENTED SYNTHETIC INDOLE AND INDAZOLE CANNABINOID DETECTION, IDENTIFICATION, AND QUANTIFICATION | HOFSTRA UNIVERSITY (US) | 2022-01-27 | — | — | US | claimed |
| EP-3638682-A1 | A METHOD FOR SYNTHESIS OF LITHIUM FLUORINATED BORATE SALTS | Seeo, Inc (US) | 2020-04-22 | — | — | EP | claimed |
| US-10287302-B2 | Method for synthesis of lithium fluorinated borate salts | SEEO, INC. (US) | 2019-05-14 | — | — | US | claimed |
| WO-2018231575-A1 | A METHOD FOR SYNTHESIS OF LITHIUM FLUORINATED BORATE SALTS | SEEO, INC. (US) | 2018-12-20 | — | — | WO | claimed |
| US-20180354976-A1 | METHOD FOR SYNTHESIS OF LITHIUM FLUORINATED BORATE SALTS | ROBERT BOSCH GMBH (DE) | 2018-12-13 | — | — | US | claimed |
| US-10131638-B1 | Synthesis of AZO intermediate | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2018-11-20 | — | — | US | claimed |
| EP-0139158-B1 | ANTIBIOTIC SB 22484 | GRUPPO LEPETIT S.p.A. (IT) | 1989-01-25 | — | — | EP | claimed |
| US-4645856-A | Process for the preparation of perdeuterated methacrylates | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1987-02-24 | — | — | US | claimed |
| US-4607012-A | Antibiotic SB 22484 | GRUPPO LEPETIT S.P.A. (IT) | 1986-08-19 | — | — | US | claimed |
| EP-0139158-A2 | Antibiotic SB 22484 | GRUPPO LEPETIT S.p.A. (IT) | 1985-05-02 | — | — | EP | claimed |