⚠ 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 | |
|---|---|---|---|---|
| 2,2,3-Trimethylbutane SCHEMBL4481319 | 1.00 | ALDH1A1 (0.44) | — | |
| 2,2,3-Trimethylbutane SCHEMBL11400965 | 0.94 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL8037694 | 0.94 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL30369120 | 0.94 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL1788862 | 0.94 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL30565590 | 0.94 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL11287489 | 0.89 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL1566753 | 0.89 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL28852478 | 0.85 | ALDH1A1 (0.36) | — | |
| 2,2,3-Trimethylbutane SCHEMBL11421995 | 0.85 | — | — |
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 4176 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-20260081215-A1 | SOLID STATE BATTERIES AND METHODS OF MAKING THEREOF | LG ENERGY SOLUTION LTD (KR) | 2026-03-19 | — | — | US | claimed |
| EP-3526314-B2 | ALKYLATE GASOLINE COMPOSITION WITH RENEWABLE NAPHTHA AND ISO-OCTANE | NESTE OYJ (FI) | 2026-03-18 | — | — | EP | claimed |
| EP-3990419-B1 | PROCESS FOR PRODUCING TRIPTANE AND/OR TRIPTENE | SHELL INT RESEARCH (NL) | 2026-03-11 | — | — | EP | claimed |
| US-20260005296-A1 | SOLID STATE BATTERIES AND METHODS OF MAKING THEREOF | LG ENERGY SOLUTION LTD (KR) | 2026-01-01 | — | — | US | claimed |
| US-12512509-B2 | Solid state batteries and methods of making thereof | LG ENERGY SOLUTION, LTD. (KR) | 2025-12-30 | — | — | US | claimed |
| WO-2025242747-A1 | MULTI -COMPONENT FORMULATIONS OF ORGANOMETALLIC REAGENTS | MERCK PATENT GMBH (DE) | 2025-11-27 | — | — | WO | claimed |
| US-20250352948-A1 | SOLVENT-BASED PROCESSES FOR FUNCTIONALIZED MATERIALS | X DEV LLC (US) | 2025-11-20 | — | — | US | claimed |
| US-12438188-B2 | Solid state batteries and methods of making thereof | LG ENERGY SOLUTION, LTD. (KR) | 2025-10-07 | — | — | US | claimed |
| US-20250266494-A1 | SOLID STATE BATTERIES AND METHODS OF MAKING THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2025-08-21 | — | — | US | claimed |
| US-20250266495-A1 | SOLID STATE BATTERIES AND METHODS OF MAKING THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2025-08-21 | — | — | US | claimed |
| US-5073666-A | Hydrocarbon synthesis from lower alkanes at advanced temperatures and high pressures | CORNELL RESEARCH FOUNDATION, INC. (US) | 1991-12-17 | — | — | US | claimed |
| US-4835171-A | Vinylureas, and fungicides containing these compounds | BASF ALTIENGESELLSCHAFT (DE) | 1989-05-30 | — | — | US | claimed |
| US-4798781-A | PHTHALO/NAPHTHALOCYANINE DYE/ | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1989-01-17 | — | — | US | claimed |
| EP-0261416-A2 | Method for the detection of 1,2,2-trimethyl propyl methyl phosphofluoridate | Battelle-Institut e.V. (DE) | 1988-03-30 | — | — | EP | claimed |
| EP-0119428-A2 | Biscarboxamides for treating diseases, and process for their preparation | BAYER AG (DE) | 1984-09-26 | — | — | EP | claimed |
| US-4418185-A | Process for nonaqueous dispersion polymerization of butadiene in the presence of high cis-1,4-polyisoprene as a polymeric dispersing agent | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1983-11-29 | — | — | US | claimed |
| US-4269832-A | 2-/SUBSTITUTED-AMINO/-4,6-BIS/ALKYLAMINO/-5-TRIAZINES AS ANTIARTHRITIC AND ANTIINFLAMMATORY AGENTS | AMERICAN CYANAMID COMPANY (US) | 1981-05-26 | — | — | US | claimed |
| US-4261892-A | ANTIINFLAMMATORY, ANTIARTHRITIC | AMERICAN CYANAMID COMPANY (US) | 1981-04-14 | — | — | US | claimed |
| US-4059647-A | Process for producing triptane by contacting methanol or dimethyl ether with zinc chloride | SHELL OIL COMPANY (US) | 1977-11-22 | — | — | US | claimed |
| US-4059646-A | Process for producing triptane by contacting methanol or dimethyl ether with zinc bromide | SHELL OIL COMPANY (US) | 1977-11-22 | — | — | US | claimed |