⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7949889 | 0.93 | — | — | |
| Whi-261 SCHEMBL26092932 | 0.85 | — | — | |
| SCHEMBL12338172 | 0.85 | — | — | |
| Whi-261 SCHEMBL26092929 | 0.85 | — | — | |
| SCHEMBL29356720 | 0.82 | HIF1A (0.49) | — | |
| SCHEMBL14500934 | 0.80 | — | — | |
| SCHEMBL14500944 | 0.80 | — | — | |
| Ethylene Glycol SCHEMBL28954976 | 0.80 | LMNA (0.41) | — | |
| SCHEMBL9084970 | 0.79 | — | — | |
| SCHEMBL13623703 | 0.78 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1091948-B9 | TUBULIN BINDING COMPOUNDS (COBRA) | PARKER HUGHES INST (US) | 2003-09-10 | — | — | EP | disclosed |
| EP-1091948-B1 | TUBULIN BINDING COMPOUNDS (COBRA) | PARKER HUGHES INST (US) | 2003-03-26 | — | — | EP | disclosed |