⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL660912 | 0.72 | — | — | |
| SCHEMBL1706186 | 0.72 | — | — | |
| SCHEMBL48575 | 0.72 | — | — | |
| SCHEMBL1682929 | 0.72 | — | — | |
| SCHEMBL515003 | 0.72 | — | — | |
| SCHEMBL11736102 | 0.72 | — | — | |
| SCHEMBL10054281 | 0.72 | — | — | |
| SCHEMBL28081962 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL2225918 | 0.67 | — | — | |
| Fluoride SCHEMBL10785799 | 0.67 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109082886-A | Thiosemicarbazides molecule covalent scion grafting acrylic fiber, preparation method and application | 武汉纺织大学 | 2018-12-25 | — | — | CN | claimed |
| CN-107331530-A | A kind of low-temperature-doped graphene and preparation method thereof and ultracapacitor | 中国科学技术大学 | 2017-11-07 | — | — | CN | claimed |
| CN-110156704-A | 1,2,4- triazole sulfide derivative and its crystal structure and application | 湖南大学 | 2019-08-23 | — | — | CN | disclosed |
| CN-109082886-A | Thiosemicarbazides molecule covalent scion grafting acrylic fiber, preparation method and application | 武汉纺织大学 | 2018-12-25 | — | — | CN | disclosed |
| EP-3290490-A1 | MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICES AND ORGANIC ELECTROLUMINESCENT DEVICES MADE BY USING THE SAME | Idemitsu Kosan Co., Ltd (JP) | 2018-03-07 | — | — | EP | disclosed |
| CN-107331530-A | A kind of low-temperature-doped graphene and preparation method thereof and ultracapacitor | 中国科学技术大学 | 2017-11-07 | — | — | CN | disclosed |
| EP-3043137-A1 | HEAT TRANSFER PIPE, METHOD FOR MANUFACTURING HEAT TRANSFER PIPE, AND HEAT EXCHANGER | Sanoh Industrial Co., Ltd. (JP) | 2016-07-13 | — | — | EP | disclosed |