⚠ 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 | |
|---|---|---|---|---|
| Lithium SCHEMBL5586555 | 0.93 | — | — | |
| Lithium SCHEMBL340188 | 0.91 | — | — | |
| SCHEMBL3018363 | 0.91 | — | — | |
| Lithium SCHEMBL32669477 | 0.83 | — | — | |
| SCHEMBL8061185 | 0.83 | — | — | |
| Lithium SCHEMBL31738468 | 0.83 | — | — | |
| Magnesium SCHEMBL8474267 | 0.83 | — | — | |
| Lithium SCHEMBL4333594 | 0.83 | — | — | |
| SCHEMBL45345 | 0.82 | — | — | |
| Barium SCHEMBL32674551 | 0.77 | — | — |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4414899-A1 | QUANTUM COMPUTER BASED SIMULATION OF PHYSICAL SYSTEMS USING QUBITIZATION OF PSEUDOPOTENTIAL HAMILTONIANS | Xanadu Quantum Technologies Inc. (CA) | 2024-08-14 | — | — | EP | claimed |
| US-11961958-B2 | 3D textured composite silicon anode and fluorinated lithium compound electrochemical cell | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2024-04-16 | — | — | US | claimed |
| US-11489219-B2 | Encapsulating in-situ energy storage device with electrode contact | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2022-11-01 | — | — | US | claimed |
| US-11322787-B2 | Encapsulating in-situ energy storage device with cathode contact | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2022-05-03 | — | — | US | claimed |
| US-11245134-B2 | Lithium energy storage device with composite anode | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2022-02-08 | — | — | US | claimed |
| US-6087042-A | LITHIUM MANGANESE OXYFLUORIDE SPINEL; HIGH ENERGY DENSITY BATTERIES | KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) | 2000-07-11 | — | — | US | claimed |
| EP-0947012-A1 | LITHIUM MANGANESE OXY-FLUORIDES FOR LI-ION RECHARGEABLE BATTERY ELECTRODES | BELL COMMUNICATIONS RESEARCH, INC. (US) | 1999-10-06 | — | — | EP | claimed |
| WO-1998010476-A1 | LITHIUM MANGANESE OXY-FLUORIDES FOR LI-ION RECHARGEABLE BATTERY ELECTRODES | BELL COMMUNICATIONS RESEARCH, INC. (US) | 1998-03-12 | — | — | WO | claimed |
| US-5674645-A | Lithium manganese oxy-fluorides for li-ion rechargeable battery electrodes | BELL COMMUNICATIONS RESEARCH, INC. (US) | 1997-10-07 | — | — | US | claimed |
| US-12170353-B2 | Method of making a lithium energy storage device | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2024-12-17 | — | — | US | disclosed |
| CN-114651358-B | Porous silicon negative electrode for rechargeable metal halide batteries | 国际商业机器公司 | 2024-09-03 | — | — | CN | disclosed |
| EP-4414899-A1 | QUANTUM COMPUTER BASED SIMULATION OF PHYSICAL SYSTEMS USING QUBITIZATION OF PSEUDOPOTENTIAL HAMILTONIANS | Xanadu Quantum Technologies Inc. (CA) | 2024-08-14 | — | — | EP | disclosed |
| US-12062761-B2 | Fabrication of all-solid-state energy storage devices | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2024-08-13 | — | — | US | disclosed |
| US-11961958-B2 | 3D textured composite silicon anode and fluorinated lithium compound electrochemical cell | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2024-04-16 | — | — | US | disclosed |
| US-6087042-A | LITHIUM MANGANESE OXYFLUORIDE SPINEL; HIGH ENERGY DENSITY BATTERIES | KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) | 2000-07-11 | — | — | US | disclosed |
| EP-0947012-A1 | LITHIUM MANGANESE OXY-FLUORIDES FOR LI-ION RECHARGEABLE BATTERY ELECTRODES | BELL COMMUNICATIONS RESEARCH, INC. (US) | 1999-10-06 | — | — | EP | disclosed |
| CN-1229528-A | Lithium manganese oxy-floor ides for Li-ion rechargeable battery electrodes | BELL COMMUNICATIONS RES (US) | 1999-09-22 | — | — | CN | disclosed |
| WO-1998010476-A1 | LITHIUM MANGANESE OXY-FLUORIDES FOR LI-ION RECHARGEABLE BATTERY ELECTRODES | BELL COMMUNICATIONS RESEARCH, INC. (US) | 1998-03-12 | — | — | WO | disclosed |
| US-5674645-A | Lithium manganese oxy-fluorides for li-ion rechargeable battery electrodes | BELL COMMUNICATIONS RESEARCH, INC. (US) | 1997-10-07 | — | — | US | disclosed |
| US-5674645-A | Lithium manganese oxy-fluorides for li-ion rechargeable battery electrodes | BELL COMMUNICATIONS RESEARCH, INC. (US) | 1997-10-07 | — | — | US | disclosed |