⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL268198 | 1.00 | — | — | |
| SCHEMBL1709336 | 1.00 | — | — | |
| Acetic Acid SCHEMBL28852386 | 0.92 | TDP1 (0.38) | — | |
| Ethyl Acetate SCHEMBL28852383 | 0.82 | ALDH1A1 (0.58) | — | |
| SCHEMBL15992208 | 0.81 | MMP1 (0.41) | — | |
| SCHEMBL11128512 | 0.81 | TDP1 (0.37) | — | |
| SCHEMBL2528138 | 0.79 | — | — | |
| SCHEMBL11466259 | 0.79 | — | — | |
| SCHEMBL637645 | 0.79 | — | — | |
| SCHEMBL2153461 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20170098788-A1 | ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2017-04-06 | — | — | US | disclosed |
| US-9487570-B2 | Glucagon like peptide analogs, composition, and method of use | BETTA PHARMACEUTICALS CO., LTD (CN) | 2016-11-08 | — | — | US | disclosed |
| US-20120088770-A1 | ALPHA HELIX MIMETICS AND METHODS RELATING THERETO | PRISM BIOLAB CORPORATION (JP) | 2012-04-12 | — | — | US | disclosed |
| US-7199265-B2 | Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones | KARO BIO AB (SE) | 2007-04-03 | — | — | US | disclosed |