⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18608531 | 0.72 | — | — | |
| Methylsulfanylmethane SCHEMBL71575 | 0.67 | — | — | |
| Methylsulfanylmethane SCHEMBL237052 | 0.62 | — | — | |
| Methylsulfanylmethane SCHEMBL3283496 | 0.62 | — | — | |
| Methylsulfanylmethane SCHEMBL8966644 | 0.62 | — | — | |
| Methylsulfanylmethane SCHEMBL1330443 | 0.61 | — | — | |
| Methylsulfanylmethane SCHEMBL1618 | 0.61 | — | — | |
| Methylsulfanylmethane SCHEMBL5440614 | 0.61 | — | — | |
| Methylsulfanylmethane SCHEMBL23701635 | 0.55 | — | — | |
| Methylsulfanylmethane SCHEMBL5139388 | 0.55 | — | — |
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 2416 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 |
|---|---|---|---|---|---|---|---|
| CN-120004908-A | Preparation method of Lugdunomycin | 南华大学 | 2025-05-16 | — | — | CN | claimed |
| CN-118215665-A | Beta-lactamase inhibitor intermediate and preparation method thereof | 苏州信诺维医药科技股份有限公司 | 2024-06-18 | — | — | CN | claimed |
| CN-114920625-B | Symmetrical double quaternary carbon organic structure guiding agent compound and preparation method and application thereof | 重庆大学 | 2023-12-19 | — | — | CN | claimed |
| WO-2023088375-A1 | β-LACTAMASE INHIBITOR INTERMEDIATE AND PREPARATION METHOD THEREFOR | 苏州信诺维医药科技股份有限公司 | 2023-05-25 | — | — | WO | claimed |
| CN-114920625-A | Symmetrical double-quaternary-carbon organic structure director compound, and preparation method and application thereof | 重庆大学 | 2022-08-19 | — | — | CN | claimed |
| CN-112574087-B | Synthetic method of 3-aminopyrrolidine hydrochloride | 南京杰运医药科技有限公司 | 2022-07-26 | — | — | CN | claimed |
| CN-109438321-B | Tryptophan derivative and preparation method and application thereof | 南京友怡医药科技有限公司 | 2021-12-17 | — | — | CN | claimed |
| CN-113717180-A | Synthesis method of 2-Boc-2, 7-diaza-spiro [4,4] nonane | 安徽大学 | 2021-11-30 | — | — | CN | claimed |
| CN-112574087-A | Synthetic method of 3-aminopyrrolidine hydrochloride | 南京杰运医药科技有限公司 | 2021-03-30 | — | — | CN | claimed |
| CN-109053789-B | Synthesis method of trimethoxy boron-oxygen hexacyclic ring | 石家庄圣泰化工有限公司 | 2020-12-01 | — | — | CN | claimed |
| EP-0215319-B1 | GEM-DIHALO-1,8-DIAMINO-4-AZA-OCTANES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-10-16 | — | — | EP | claimed |
| CN-1012732-B | GEN-DIHALO-1, 8-DIAMINO-4-AZA-OCTANES | MERRELL DOW PHARMA (US) | 1991-06-05 | — | — | CN | claimed |
| CN-1043130-A | QUINUCLIDINE THERAPEUTIC AGENTS | PFIZER (US) | 1990-06-20 | — | — | CN | claimed |
| US-4914240-A | PROTECTING DIHALO BUTANEDIOL, REACTING WITH POTASSIUM PHTHALIMINDE, DEPROTECTING; MULTISTEP | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-04-03 | — | — | US | claimed |
| US-4837328-A | Stereoselective reaction for hexahydro-6-arylpyrrolo(2,1-A) isoquinolines | MCNEILAB, INC. (US) | 1989-06-06 | — | — | US | claimed |
| EP-0220409-A2 | Gem-dihalo and tetrahalo-1,12-diamino-4,9-diaza-dodecanes | MERRELL DOW PHARMACEUTICALS INC. (US) | 1987-05-06 | — | — | EP | claimed |
| CN-86105088-A | Preparation is together with-dihalo-and four halos-1,12-diamino-4, the method for 9-diaza-dodecane | — | 1987-04-29 | — | — | CN | claimed |
| CN-86105154-A | Together with-dihalo-1, the preparation method of 8-diamino-4-azepine-octane | — | 1987-04-22 | — | — | CN | claimed |
| EP-0215319-A2 | Gem-dihalo-1,8-diamino-4-aza-octanes | MERRELL DOW PHARMACEUTICALS INC. (US) | 1987-03-25 | — | — | EP | claimed |
| EP-0012622-B1 | 1-TOSLOXY-2,2-ETHYLENEDIOXY-6,10-DIMETHYL UNDECANES AND UNDECENES, PROCESS FOR THE PREPARATION OF 2S*,3R*-3-BENZYLOXY-6,6-ETHYLENE DIOXY-2-METHYL-2-(5'-HYDROXY-4'-METHYLPENTYL)-OXEPANE, AND USE OF THE LATTER FOR THE PREPARATION OF OXEPAN-3-OL DERIVATIVES | ORTHO PHARMACEUTICAL CORPORATION (US) | 1982-12-15 | — | — | EP | claimed |