⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19792709 | 0.95 | MEN1 (0.33) | — | |
| SCHEMBL15724568 | 0.89 | TYR (0.31) | — | |
| SCHEMBL12610358 | 0.89 | TYR (0.31) | — | |
| SCHEMBL12610389 | 0.89 | TYR (0.31) | — | |
| SCHEMBL12610349 | 0.84 | — | — | |
| SCHEMBL12610241 | 0.84 | — | — | |
| SCHEMBL12610242 | 0.83 | — | — | |
| SCHEMBL862401 | 0.83 | TYR (0.35) | — | |
| SCHEMBL12593277 | 0.83 | TYR (0.35) | — | |
| SCHEMBL12887014 | 0.82 | MAPT (0.32) | — |
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-8530889-B2 | Carbon nanotube composite, organic semiconductor composite, and field-effect transistor | TORAY INDUSTRIES, INC. (JP) | 2013-09-10 | — | — | US | disclosed |
| US-20110121273-A1 | CARBON NANOTUBE COMPOSITE, ORGANIC SEMICONDUCTOR COMPOSITE, AND FIELD-EFFECT TRANSISTOR | TORAY INDUSTRIES, INC. (JP) | 2011-05-26 | — | — | US | disclosed |