⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL247187 | 0.97 | — | — | |
| SCHEMBL498051 | 0.97 | — | — | |
| SCHEMBL1657133 | 0.94 | ALDH1A1 (0.45) | — | |
| SCHEMBL10136292 | 0.94 | ALDH1A1 (0.45) | — | |
| Ammonia Solution, Strong SCHEMBL3718705 | 0.94 | CYP4F2 (0.40) | — | |
| SCHEMBL14809124 | 0.94 | ALDH1A1 (0.45) | — | |
| SCHEMBL16590622 | 0.94 | ALDH1A1 (0.45) | — | |
| SCHEMBL1626845 | 0.94 | ALDH1A1 (0.45) | — | |
| SCHEMBL4108517 | 0.94 | ALDH1A1 (0.45) | — | |
| SCHEMBL1657992 | 0.94 | ALDH1A1 (0.45) | — |
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 667 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805022-B | Preparation device and preparation method of trimethylbutane | 本田技研工业株式会社 | 2024-06-25 | — | — | CN | claimed |
| CN-115003659-A | 5-membered heteroaryl amino sulfonamides for the treatment of conditions mediated by a deficiency in CFTR activity | 健赞公司 | 2022-09-02 | — | — | CN | claimed |
| CN-114805022-A | Preparation device and preparation method of trimethylbutane | 本田技研工业株式会社 | 2022-07-29 | — | — | CN | claimed |
| CN-112940813-A | Oxygen-containing type secondary standard fuel with low cetane number | 军事科学院系统工程研究院军事新能源技术研究所 | 2021-06-11 | — | — | CN | claimed |
| CN-112940812-A | Oxygen-containing type high-cetane number secondary standard fuel | 军事科学院系统工程研究院军事新能源技术研究所 | 2021-06-11 | — | — | CN | claimed |
| WO-2021097057-A1 | 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY | GENZYME CORPORATION (US) | 2021-05-20 | — | — | WO | claimed |
| EP-0804381-A1 | CASTING TOOLING | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1997-11-05 | — | — | EP | claimed |
| WO-1995015919-A1 | CASTING TOOLING | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1995-06-15 | — | — | WO | claimed |
| US-4272364-A | 4,4-DIMETHYL-1-PENTANOL | CALGON CORPORATION (US) | 1981-06-09 | — | — | US | claimed |
| US-12630498-B2 | Arylamides and methods of use thereof | GENZYME CORPORATION (US) | 2026-05-19 | — | — | US | disclosed |
| WO-2025129104-A1 | COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF | SIONNA THERAPEUTICS INC. (US) | 2025-06-19 | — | — | WO | disclosed |
| US-20240410055-A1 | METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS | MERCK PATENT GMBH (DE) | 2024-12-12 | — | — | US | disclosed |
| US-20240368189-A1 | Modulators of Cystic Fibrosis Transmembrane Conductance Regulator, Pharmaceutical Compositions, Methods of Treatment, and Process for Making the Modulators | VERTEX PHARMA (US) | 2024-11-07 | — | — | US | disclosed |
| US-12043629-B2 | RIP1K inhibitors | RIGEL PHARMACEUTICALS, INC. (US) | 2024-07-23 | — | — | US | disclosed |
| US-4588848-A | NEOACIDS, HYDROGENATION, COPPER OXIDE-ZINC OXIDE-ALUMINA CATALYST,GAS FLOW | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1986-05-13 | — | — | US | disclosed |
| EP-0180210-A2 | Synthesis of Neoalkanols | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1986-05-07 | — | — | EP | disclosed |
| EP-0180240-A1 | Synthesis of neoalkanes | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1986-05-07 | — | — | EP | disclosed |
| US-4272364-A | 4,4-DIMETHYL-1-PENTANOL | CALGON CORPORATION (US) | 1981-06-09 | — | — | US | disclosed |
| US-4272364-A | 4,4-DIMETHYL-1-PENTANOL | CALGON CORPORATION (US) | 1981-06-09 | — | — | US | disclosed |
| US-4125544-A | 20/22/23/24-Oxa-7-oxocholesterols and esters thereof | G. D. SEARLE (US) | 1978-11-14 | — | — | US | disclosed |