⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL51455 | 0.95 | — | — | |
| SCHEMBL27429889 | 0.90 | — | — | |
| Water SCHEMBL27814159 | 0.90 | — | — | |
| SCHEMBL27800090 | 0.90 | — | — | |
| SCHEMBL18813463 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL27838021 | 0.90 | — | — | |
| Fluoride SCHEMBL28008989 | 0.90 | — | — | |
| Trimethylammonium SCHEMBL4267426 | 0.82 | ALDH1A1 (0.33) | — | |
| Dimethylamine SCHEMBL4260162 | 0.82 | — | — | |
| Isopropyl Alcohol SCHEMBL28069223 | 0.76 | ALDH1A1 (0.43) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4599393-A | Method for polymerizing lactams and products obtained therefrom | GENERAL ELECTRIC COMPANY (US) | 1986-07-08 | — | — | US | claimed |
| CN-107079560-B | Organic el display device | 东丽株式会社 | 2018-09-25 | — | — | CN | disclosed |
| CN-106715597-A | Resin composition, method for producing heat-resistant resin film, and display device | 东丽株式会社 | 2017-05-24 | — | — | CN | disclosed |
| CN-106415393-A | Negative photosensitive resin composition, cured film obtained by curing same, method for producing cured film, optical device provided with cured film, and backside-illuminated CMOS image sensor | 东丽株式会社 | 2017-02-15 | — | — | CN | disclosed |
| CN-104380843-B | Organic electroluminescent element and method for manufacturing the same | 吉坤日矿日石能源株式会社 | 2016-10-19 | — | — | CN | disclosed |
| CN-105993065-A | Semiconductor element manufacturing method | 国立大学法人东北大学 | 2016-10-05 | — | — | CN | disclosed |