⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14318463 | 0.74 | — | — | |
| SCHEMBL27097642 | 0.73 | — | — | |
| SCHEMBL20779744 | 0.67 | — | — | |
| SCHEMBL16883905 | 0.65 | — | — | |
| SCHEMBL25522456 | 0.65 | — | — | |
| SCHEMBL5275842 | 0.65 | — | — | |
| SCHEMBL26198116 | 0.62 | — | — | |
| SCHEMBL17803826 | 0.56 | — | — | |
| SCHEMBL21981214 | 0.56 | — | — | |
| SCHEMBL441059 | 0.56 | TSHR (0.31) | — |
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-9267949-B2 | Alkylamino BODIPY dyes as selective fluorescent probes for proteins and mouse embryonic stem cells | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2016-02-23 | — | — | US | disclosed |
| US-20140121129-A1 | Alkylamino BODIPY Dyes As Selective Fluorescent Probes For Proteins And Mouse Embryonic Stem Cells | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2014-05-01 | — | — | US | disclosed |