⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10245481 | 0.93 | — | — | |
| SCHEMBL8560 | 0.73 | — | — | |
| SCHEMBL4923961 | 0.73 | — | — | |
| SCHEMBL18112474 | 0.70 | — | — | |
| SCHEMBL8461479 | 0.70 | TRIM24 (0.38) | — | |
| SCHEMBL8461935 | 0.70 | TRIM24 (0.38) | — | |
| SCHEMBL19178733 | 0.70 | TRIM24 (0.38) | — | |
| SCHEMBL19178734 | 0.70 | TRIM24 (0.38) | — | |
| SCHEMBL16860543 | 0.70 | TRIM24 (0.38) | — | |
| SCHEMBL8461939 | 0.70 | TRIM24 (0.38) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230265065-A1 | SELECTIVE PHOSPHATASE INHIBITORS BASED ON ILLUDALIC ACID | THE WEST VIRGINIA UNIVERSITY BOARD OF GOVERNORS ON BEHALF OF WEST VIRGINIA UNIVERSITY | 2023-08-24 | — | — | US | disclosed |
| WO-2017134555-A1 | DERIVATIVES OF PYRROLOIMIDAZOLE OR ANALOGUES THEREOF WHICH ARE USEFUL FOR THE TREATMENT OF INTER ALIA CANCER | EMCURE PHARMACEUTICALS LIMITED (IN) | 2017-08-10 | — | — | WO | disclosed |
| US-4138583-A | ANTICOAGULANTS, CARDIOVASCULAR DISORDERS, HYPOTENSIVE AGENTS | MILES LABORATORIES, INC. (US) | 1979-02-06 | — | — | US | disclosed |
| US-4138582-A | ANTICOAGULANTS, CARDIOVASCULAR DISORDERS, HYPOTENSIVE AGENTS | MILES LABORATORIES, INC. (US) | 1979-02-06 | — | — | US | disclosed |
| US-4066834-A | Cycloalkenyl analogues of prostaglandins E | MILES LABORATORIES, INC. (US) | 1978-01-03 | — | — | US | disclosed |