⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14682698 | 0.87 | MAPT (0.34) | — | |
| SCHEMBL10239514 | 0.78 | MEN1 (0.41) | — | |
| SCHEMBL21173300 | 0.76 | MAPT (0.42) | — | |
| SCHEMBL22031944 | 0.76 | — | — | |
| SCHEMBL11985092 | 0.74 | TSHR (0.38) | — | |
| SCHEMBL13354743 | 0.73 | — | — | |
| SCHEMBL12337158 | 0.73 | MEN1 (0.32) | — | |
| SCHEMBL19822808 | 0.71 | RARA (0.35) | — | |
| SCHEMBL22245948 | 0.69 | RAB9A (0.36) | — | |
| SCHEMBL18330268 | 0.68 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200247998-A1 | DYES, DYE-SENSITIZED SOLAR CELLS, AND METHODS OF MAKING AND USING THE SAME | UNIVERSITY OF MISSISSIPPI | 2020-08-06 | — | — | US | disclosed |