⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11660976 | 1.00 | — | — | |
| SCHEMBL11654378 | 0.85 | — | — | |
| SCHEMBL11654371 | 0.85 | — | — | |
| SCHEMBL11656400 | 0.82 | — | — | |
| SCHEMBL11659224 | 0.81 | MCL1 (0.31) | — | |
| SCHEMBL11659216 | 0.81 | MCL1 (0.31) | — | |
| SCHEMBL11656834 | 0.80 | — | — | |
| SCHEMBL11656841 | 0.80 | — | — | |
| SCHEMBL11656866 | 0.80 | — | — | |
| SCHEMBL11657026 | 0.80 | — | — |
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-4117154-A | INSECTICIDES, ACARICIDES, NEMATOCIDES, FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-26 | — | — | US | disclosed |