⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12923870 | 0.75 | TSHR (0.40) | — | |
| SCHEMBL269873 | 0.75 | — | — | |
| SCHEMBL18416515 | 0.75 | — | — | |
| SCHEMBL800918 | 0.73 | — | — | |
| SCHEMBL28131341 | 0.73 | — | — | |
| SCHEMBL18099934 | 0.73 | — | — | |
| SCHEMBL27592982 | 0.73 | ALDH1A1 (0.48) | — | |
| SCHEMBL18099936 | 0.73 | — | — | |
| SCHEMBL2317854 | 0.71 | — | — | |
| SCHEMBL9793701 | 0.71 | — | — |
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-20180065932-A1 | ANTIVIRAL COMPOUNDS | ALIOS BIOPHARMA, INC. | 2018-03-08 | — | — | US | disclosed |
| US-9505773-B2 | Rapamycin analogues and their pharmaceutical use | Isomerase Therapeutics Ltd. (GB) | 2016-11-29 | — | — | US | disclosed |
| US-20160176893-A1 | RAPAMYCIN ANALOGUES AND THEIR PHARMACEUTICAL USE | ISOMERASE THERAPEUTICS, LTD. (GB) | 2016-06-23 | — | — | US | disclosed |
| US-20150065504-A1 | ANTIVIRAL COMPOUNDS | ALIOS BIOPHARMA, INC. | 2015-03-05 | — | — | US | disclosed |
| US-20080021079-A1 | Compounds, Compositions, and Methods | CYTOKINETICS, INC. | 2008-01-24 | — | — | US | disclosed |