⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7922291 | 0.81 | — | — | |
| SCHEMBL8524589 | 0.71 | — | — | |
| SCHEMBL728340 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL6265034 | 0.69 | — | — | |
| SCHEMBL727006 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL7640397 | 0.68 | — | — | |
| SCHEMBL3842347 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL7205680 | 0.67 | — | — | |
| SCHEMBL8760310 | 0.66 | — | — | |
| SCHEMBL5677185 | 0.66 | — | — |
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-5969062-A | FORMIMG A POLYMER OF ETHYLENE WITH C3-C10-ALK-1-ENES IN PRESENCE OF A CATALYST SYSTEM CONTAINING A DONOR SUBSTITUTED MONOCYCLOPENTADIENYLAMIDO(TRANSITIONAL METAL) COMPLEX, A COMPOUND CAPABLE OF FORMING METALLOCENE IONS | BASF AKTIENGESELLSCHAFT (DE) | 1999-10-19 | — | — | US | disclosed |