⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14409786 | 0.77 | — | — | |
| SCHEMBL3394984 | 0.75 | — | — | |
| SCHEMBL6753813 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL7781379 | 0.74 | — | — | |
| SCHEMBL12952139 | 0.72 | — | — | |
| SCHEMBL27867647 | 0.72 | CA12 (0.38) | — | |
| SCHEMBL13103806 | 0.72 | — | — | |
| SCHEMBL17866352 | 0.72 | — | — | |
| Phosphine SCHEMBL4362247 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL1919181 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1973923-B1 | INTERMEDIATE COMPOUND OF TECHNETIUM NITRIDE COMPLEX FOR RADIODIAGNOSTIC IMAGING | NIHON MEDIPHYSICS CO LTD (JP) | 2011-08-17 | — | — | EP | disclosed |