⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3088952 | 1.00 | — | — | |
| SCHEMBL11482957 | 0.82 | FUCA1 (0.35) | — | |
| SCHEMBL11264365 | 0.81 | — | — | |
| SCHEMBL855731 | 0.79 | — | — | |
| SCHEMBL27968114 | 0.76 | LMNA (0.53) | — | |
| SCHEMBL10053033 | 0.73 | — | — | |
| SCHEMBL13207457 | 0.71 | — | — | |
| SCHEMBL12989696 | 0.71 | — | — | |
| SCHEMBL334764 | 0.71 | — | — | |
| SCHEMBL1711523 | 0.71 | LMNA (0.50) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11780787-B2 | Method for conversion of diols to olefin products | UT-BATTELLE, LLC (US) | 2023-10-10 | — | — | US | disclosed |
| US-20230242464-A1 | METHOD FOR CONVERSION OF DIOLS TO OLEFIN PRODUCTS | UT BATTELLE LLC (US) | 2023-08-03 | — | — | US | disclosed |
| US-20160272612-A1 | ANTHROPOD REPELLENT CHEMICALS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2016-09-22 | — | — | US | disclosed |
| US-9133218-B2 | Pesticidally active pyridyl- and pyrimidyl-substituted thiazole derivatives | SYNGENTA PARTICIPATIONS AG (CH) | 2015-09-15 | — | — | US | disclosed |
| US-20150141423-A1 | PESTICIDALLY ACTIVE PYRIDYL- AND PYRIMIDYL- SUBSTITUTED THIAZOLE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2015-05-21 | — | — | US | disclosed |
| WO-2007097719-A1 | CYCLISATION PROCESS OF FORMING A MULTIPLE RING COMPOUND | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2007-08-30 | — | — | WO | disclosed |