⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30143 | 0.79 | — | — | |
| SCHEMBL4423459 | 0.75 | — | — | |
| Acetic Acid SCHEMBL7704494 | 0.73 | — | — | |
| SCHEMBL27553773 | 0.71 | ALDH1A1 (0.54) | — | |
| SCHEMBL37752 | 0.71 | — | — | |
| SCHEMBL6924582 | 0.71 | HCAR2 (0.55) | — | |
| Ammonia Solution, Strong SCHEMBL451202 | 0.68 | — | — | |
| SCHEMBL6528410 | 0.68 | — | — | |
| SCHEMBL7045611 | 0.68 | — | — | |
| SCHEMBL18154634 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019135604-A1 | METHOD FOR PRODUCING LACTAM COMPOUND, AND LACTAM COMPOUND PRODUCED THEREBY | 기초과학연구원 | 2019-07-11 | — | — | WO | disclosed |
| CN-104160273-A | Sandwich assay for immunosuppressant drugs | SIEMENS HEALTHCARE DIAGNOSTICS | 2014-11-19 | — | — | CN | disclosed |
| US-6248770-B1 | CARDIOVASCULAR DISORDERS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-06-19 | — | — | US | disclosed |