⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22193800 | 0.62 | — | — | |
| SCHEMBL33790 | 0.58 | — | — | |
| SCHEMBL7718436 | 0.57 | — | — | |
| SCHEMBL9774599 | 0.52 | — | — | |
| SCHEMBL22698345 | 0.46 | — | — | |
| SCHEMBL9435983 | 0.44 | MEN1 (0.89) | — | |
| SCHEMBL3966459 | 0.44 | — | — | |
| SCHEMBL135806 | 0.41 | CYP3A4 (0.43) | — | |
| SCHEMBL30884128 | 0.41 | CYP3A4 (0.43) | — | |
| Ethane SCHEMBL5726956 | 0.40 | MEN1 (0.73) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114057777-B | Beta-carboline derivative and preparation method and application thereof | 南方海洋科学与工程广东省实验室(湛江) | 2022-12-02 | — | — | CN | disclosed |
| WO-2014000058-A1 | METHOD OF TREATING GLUCOSE METABOLISM DISORDERS | GARVAN INSTITUTE OF MEDICAL RESEARCH (AU) | 2014-01-03 | — | — | WO | disclosed |
| US-4988603-A | RAPID DEVELOPMENT OF SILVER HALIDE PHOTOGRAPHIC MATERIAL; PHOTOSENSITIVITY; HIGH DOT QUALITY | KONICA CORPORATION (JP) | 1991-01-29 | — | — | US | disclosed |
| EP-0324391-A2 | Method for the formation of high-contrast images | KONICA CORPORATION (JP) | 1989-07-19 | — | — | EP | disclosed |