⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2326557 | 0.78 | — | — | |
| SCHEMBL10090176 | 0.78 | — | — | |
| SCHEMBL23851485 | 0.77 | KMT2A (0.56) | — | |
| SCHEMBL4982361 | 0.75 | KMT2A (0.48) | — | |
| SCHEMBL15272327 | 0.73 | KMT2A (0.58) | — | |
| SCHEMBL11151822 | 0.73 | KMT2A (0.58) | — | |
| SCHEMBL15272598 | 0.73 | KMT2A (0.58) | — | |
| SCHEMBL1428658 | 0.72 | — | — | |
| SCHEMBL11213291 | 0.72 | — | — | |
| SCHEMBL8571726 | 0.72 | KMT2A (0.41) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113304260-A | Anti-tumor nano-drug with chemotherapy sensitization and chemotherapy protection and preparation method thereof | 淮阴工学院 | 2021-08-27 | — | — | CN | claimed |
| CN-112603909-A | Photo-thermal rapid controlled release nano-drug and preparation method thereof | 淮阴工学院 | 2021-04-06 | — | — | CN | claimed |
| CN-106083779-B | A kind of synthetic method of 2,5- furandicarboxylic acids | 绵阳高新区达高特科技有限公司 | 2018-08-17 | — | — | CN | claimed |
| CN-106083779-A | A kind of synthetic method of 2,5 furandicarboxylic acids | 绵阳高新区达高特科技有限公司 | 2016-11-09 | — | — | CN | claimed |
| CN-112603909-B | Photo-thermal rapid controlled release nano-drug and preparation method thereof | 淮阴工学院 | 2022-01-04 | — | — | CN | disclosed |
| CN-113304260-A | Anti-tumor nano-drug with chemotherapy sensitization and chemotherapy protection and preparation method thereof | 淮阴工学院 | 2021-08-27 | — | — | CN | disclosed |
| CN-112603909-A | Photo-thermal rapid controlled release nano-drug and preparation method thereof | 淮阴工学院 | 2021-04-06 | — | — | CN | disclosed |
| CN-111326799-A | Flame-retardant high-voltage electrolyte for lithium ion battery and preparation method thereof | 天津中电新能源研究院有限公司 | 2020-06-23 | — | — | CN | disclosed |
| US-4235685-A | BROMINATION OF ALKYL HETEROCYCLIC COMPOUNDS USING INFRARED RADIATION AS A FREE RADICAL INITIATOR | ETHYL CORPORATION (US) | 1980-11-25 | — | — | US | disclosed |