⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28301043 | 0.83 | MEN1 (0.30) | — | |
| SCHEMBL9721254 | 0.79 | MEN1 (0.30) | — | |
| SCHEMBL8184593 | 0.78 | — | — | |
| SCHEMBL28151322 | 0.78 | — | — | |
| Methane SCHEMBL1532540 | 0.77 | — | — | |
| SCHEMBL28160120 | 0.77 | — | — | |
| SCHEMBL29289460 | 0.77 | ALDH1A1 (0.33) | — | |
| SCHEMBL11870670 | 0.75 | PKM (0.31) | — | |
| SCHEMBL28445986 | 0.75 | SLC6A4 (0.33) | — | |
| SCHEMBL483506 | 0.75 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6472114-B2 | ELECTRIC CHARGE GENERATING MATERIAL, A BINDING RESIN, A SILICON OIL HAVING A SPECIFIED SURFACE TENSION, AND AN ORGANIC SOLVENT; FOR USE WITH COPIERS, A PRINTER OR A FACSIMILE | SHARP KABUSHIKI KAISHA (JP) | 2002-10-29 | — | — | US | disclosed |
| US-20020051921-A1 | Coating fluid for electric charge generating layer, organic electrophotographic receptor, and method fo manufacturing the same | SHARP KABUSHIKI KAISHA (JP) | 2002-05-02 | — | — | US | disclosed |