⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11018193 | 0.91 | — | — | |
| SCHEMBL30130 | 0.91 | — | — | |
| SCHEMBL4551936 | 0.86 | TSHR (0.35) | — | |
| Sulfuric Acid SCHEMBL11373721 | 0.83 | TSHR (0.33) | — | |
| Methacrylic Acid SCHEMBL6049662 | 0.81 | TGFBR1 (0.38) | — | |
| SCHEMBL3863145 | 0.76 | TSHR (0.32) | — | |
| Isobutanol SCHEMBL3686201 | 0.70 | — | — | |
| SCHEMBL9722432 | 0.69 | — | — | |
| SCHEMBL839088 | 0.69 | — | — | |
| SCHEMBL27831658 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008035368-A2 | CORE BOARD | BILTUBE INDIA LIMITED (IN) | 2008-03-27 | — | — | WO | claimed |
| EP-1889972-A1 | Core board | Biltube India Limited (IN) | 2008-02-20 | — | — | EP | claimed |
| WO-2008035368-A2 | CORE BOARD | BILTUBE INDIA LIMITED (IN) | 2008-03-27 | — | — | WO | disclosed |
| EP-1889972-A1 | Core board | Biltube India Limited (IN) | 2008-02-20 | — | — | EP | disclosed |