⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL233156 | 0.91 | — | — | |
| SCHEMBL448076 | 0.74 | — | — | |
| Ethylenediamine SCHEMBL7123846 | 0.72 | — | — | |
| Ethylenediamine SCHEMBL4047330 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL28883845 | 0.72 | DNM1 (0.33) | — | |
| SCHEMBL37576 | 0.72 | NFKB1 (0.39) | — | |
| Cyclopropane SCHEMBL11764922 | 0.72 | DNM1 (0.31) | — | |
| SCHEMBL12898467 | 0.71 | — | — | |
| Ethylenediamine SCHEMBL2099890 | 0.71 | KDM4E (0.32) | — | |
| SCHEMBL25198528 | 0.70 | DNM1 (0.42) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009001235-A1 | METHODS AND COMPOSITIONS FOR SELECTIVELY DISSOLVING SANDSTONE FORMATIONS | SCHLUMBERGER CANADA LIMITED (CA) | 2008-12-31 | — | — | WO | disclosed |