⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL368852 | 0.79 | TDP1 (0.36) | — | |
| SCHEMBL14341602 | 0.71 | TDP1 (0.33) | — | |
| SCHEMBL19480256 | 0.65 | — | — | |
| SCHEMBL14733253 | 0.62 | — | — | |
| SCHEMBL8827325 | 0.62 | TDP1 (0.33) | — | |
| SCHEMBL11643396 | 0.59 | — | — | |
| SCHEMBL14733245 | 0.57 | — | — | |
| SCHEMBL19523376 | 0.57 | TDP1 (0.42) | — | |
| SCHEMBL305072 | 0.57 | — | — | |
| SCHEMBL15480699 | 0.55 | TDP1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4260552-A | INSECTICIDES, HERBICIDES | UNIROYAL, INC. (US) | 1981-04-07 | — | — | US | disclosed |
| US-4160846-A | Method for controlling insects with tetrasubstituted organotin compounds | UNIROYAL, INC. (US) | 1979-07-10 | — | — | US | disclosed |