⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2261147 | 0.78 | — | — | |
| SCHEMBL9455082 | 0.63 | — | — | |
| SCHEMBL2913542 | 0.63 | — | — | |
| SCHEMBL9671335 | 0.62 | — | — | |
| SCHEMBL20089253 | 0.59 | — | — | |
| SCHEMBL9305608 | 0.59 | KMT2A (0.31) | — | |
| SCHEMBL11506981 | 0.59 | — | — | |
| SCHEMBL6086338 | 0.59 | — | — | |
| SCHEMBL12430912 | 0.59 | — | — | |
| SCHEMBL1467334 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-RE38188-E1 | Ethylene derivatives and pesticides containing said derivatives | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2003-07-15 | — | — | US | disclosed |