⚠ 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 | |
|---|---|---|---|---|
| Butane SCHEMBL2858309 | 0.94 | — | — | |
| Carbon Tetrachloride SCHEMBL29456466 | 0.88 | — | — | |
| Butane SCHEMBL2470336 | 0.84 | TSHR (0.50) | — | |
| Butane SCHEMBL9292387 | 0.84 | TSHR (0.50) | — | |
| Butane SCHEMBL8628663 | 0.84 | TSHR (0.50) | — | |
| Butane SCHEMBL1734106 | 0.84 | — | — | |
| Butane SCHEMBL3593 | 0.84 | — | — | |
| Butane SCHEMBL10663155 | 0.80 | — | — | |
| Butane SCHEMBL1325706 | 0.80 | — | — | |
| Butane SCHEMBL11884272 | 0.80 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1500830-A | Polystyrene (PS) plastic-wood panel | 华昌工贸有限公司 | 2004-06-02 | — | — | CN | claimed |
| CN-106414512-B | Method for producing aqueous fluoropolymer dispersion | 大金工业株式会社 | 2018-10-16 | — | — | CN | disclosed |
| CN-104812781-B | The manufacturing method of aqueous dispersion of polytetrafluoroethyland | 大金工业株式会社 | 2018-10-16 | — | — | CN | disclosed |
| CN-107163202-A | Triblock copolymer of poly- N vinyl carbazoles and polyisobutene and preparation method thereof | 北京石油化工学院 | 2017-09-15 | — | — | CN | disclosed |
| CN-106414512-A | Method for producing aqueous fluoropolymer dispersion | 大金工业株式会社 | 2017-02-15 | — | — | CN | disclosed |
| CN-1500830-A | Polystyrene (PS) plastic-wood panel | 华昌工贸有限公司 | 2004-06-02 | — | — | CN | disclosed |
| US-5591832-A | Benzylated lignocellulosic substance and a producing method thereof | JAPAN CHEMICAL ENGINEERING & MACHINERY CO., LTD. (JP) | 1997-01-07 | — | — | US | disclosed |
| US-5548069-A | MERCERIZING WOOD; BENZYLATING WITH BENZYL CHLORIDE | JAPAN CHEMICAL ENGINEERING & MACHINERY CO., LTD. (JP) | 1996-08-20 | — | — | US | disclosed |