⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL301095 | 0.76 | — | — | |
| SCHEMBL578217 | 0.72 | — | — | |
| SCHEMBL12002953 | 0.69 | CYP1A2 (0.47) | — | |
| Hydrazinecarboxamide SCHEMBL1306295 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL28279433 | 0.69 | LMNA (0.53) | — | |
| Hydrochloric Acid SCHEMBL11850151 | 0.69 | — | — | |
| SCHEMBL28421031 | 0.69 | — | — | |
| Hydrazine SCHEMBL22635808 | 0.69 | — | — | |
| SCHEMBL10139156 | 0.69 | — | — | |
| SCHEMBL26695487 | 0.67 | — | — |
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-6172070-B1 | IN POLYOXYETHYLENE GLYCOL CARRIER | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES | 2001-01-09 | — | — | US | claimed |