⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2101839 | 0.71 | MAPT (0.53) | — | |
| SCHEMBL147275 | 0.71 | — | — | |
| SCHEMBL11432428 | 0.69 | ALDH1A1 (0.52) | — | |
| SCHEMBL7932812 | 0.69 | — | — | |
| SCHEMBL9615865 | 0.69 | SRD5A2 (0.55) | — | |
| SCHEMBL157488 | 0.67 | — | — | |
| SCHEMBL94869 | 0.67 | TSHR (0.71) | — | |
| SCHEMBL609397 | 0.67 | MAPT (0.33) | — | |
| SCHEMBL2642316 | 0.66 | KDM4E (0.52) | — | |
| SCHEMBL1468317 | 0.65 | LMNA (0.59) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8715635-B2 | Frictionless molecular rotary motors | TECHNION RESEARCH & DEVELOPMENT FOUNDATION LIMITED (IL) | 2014-05-06 | — | — | US | disclosed |
| US-20100016610-A1 | FRICTIONLESS MOLECULAR ROTARY MOTORS | TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) | 2010-01-21 | — | — | US | disclosed |
| WO-2008096360-A2 | FRICTIONLESS MOLECULAR ROTARY MOTORS | TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) | 2008-08-14 | — | — | WO | disclosed |