⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11805574 | 0.80 | CYP2C19 (0.37) | — | |
| SCHEMBL10014404 | 0.75 | — | — | |
| SCHEMBL8340216 | 0.75 | — | — | |
| SCHEMBL2112190 | 0.75 | CYP2C19 (0.42) | — | |
| SCHEMBL426229 | 0.73 | — | — | |
| SCHEMBL8960277 | 0.72 | — | — | |
| SCHEMBL7088538 | 0.71 | — | — | |
| SCHEMBL1275144 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL9127361 | 0.71 | — | — | |
| SCHEMBL9197945 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105182687-B | Non- roasting conductive resin composition and conducting channel | 太阳油墨制造株式会社 | 2019-11-15 | — | — | CN | disclosed |
| CN-106861630-B | A kind of targeting anchoring release agent of sulfide and its preparation method and application | 中国石油大学(北京) | 2019-09-24 | — | — | CN | disclosed |
| CN-109790284-A | Polyphenol compound and process for producing the same | 三菱化学株式会社 | 2019-05-21 | — | — | CN | disclosed |
| CN-103120037-B | Method of treating copper surfaces to enhance adhesion to organic substrates used in printed circuit boards | 纳美仕有限公司 | 2017-05-10 | — | — | CN | disclosed |
| US-5482962-A | Insecticidal N,N'-disubstituted-N-N'-diacylhydrazines | ROHM AND HAAS COMPANY (US) | 1996-01-09 | — | — | US | disclosed |