⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8449304 | 0.70 | — | — | |
| SCHEMBL15218627 | 0.66 | — | — | |
| SCHEMBL15130316 | 0.65 | — | — | |
| SCHEMBL5788576 | 0.62 | — | — | |
| SCHEMBL7107068 | 0.61 | — | — | |
| SCHEMBL11037850 | 0.59 | TSHR (0.37) | — | |
| SCHEMBL1314325 | 0.56 | — | — | |
| SCHEMBL26027230 | 0.54 | — | — | |
| SCHEMBL26027229 | 0.54 | — | — | |
| SCHEMBL10353184 | 0.54 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0502690-B1 | Cyclopropane derivative | AJINOMOTO KK (JP) | 1999-12-01 | — | — | EP | disclosed |
| US-5449840-A | Viricides | AJINOMOTO CO., INC. (JP) | 1995-09-12 | — | — | US | disclosed |
| US-5342840-A | Viricides | AJINOMOTO CO., INC. (JP) | 1994-08-30 | — | — | US | disclosed |
| EP-0502690-A2 | Cyclopropane derivative | Ajinomoto Co., Inc. (JP) | 1992-09-09 | — | — | EP | disclosed |