⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19675567 | 0.75 | — | — | |
| SCHEMBL18431917 | 0.73 | — | — | |
| SCHEMBL4550927 | 0.73 | — | — | |
| SCHEMBL19477287 | 0.73 | — | — | |
| SCHEMBL6878055 | 0.70 | — | — | |
| SCHEMBL24018469 | 0.69 | — | — | |
| SCHEMBL17327603 | 0.68 | — | — | |
| SCHEMBL29335787 | 0.67 | — | — | |
| SCHEMBL15133855 | 0.67 | — | — | |
| SCHEMBL12831667 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200330625-A1 | SYNTHESIS AND COMPOSITION OF PHOTODYNAMIC THERAPEUTIC AGENTS FOR THE TARGETED TREATMENT OF CANCER | On Target Laboratories, Inc. | 2020-10-22 | — | — | US | disclosed |
| WO-2019113173-A1 | HEPATITIS B ANTIVIRAL AGENTS | ENANTA PHARMACEUTICALS, INC. (US) | 2019-06-13 | — | — | WO | disclosed |