⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22970 | 0.82 | — | — | |
| SCHEMBL6660010 | 0.76 | — | — | |
| Bromide SCHEMBL27834284 | 0.76 | — | — | |
| Lithium SCHEMBL29924411 | 0.76 | — | — | |
| SCHEMBL389591 | 0.76 | — | — | |
| Propane SCHEMBL25366971 | 0.76 | — | — | |
| Propane SCHEMBL23590 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL28211772 | 0.76 | — | — | |
| Ethyne SCHEMBL10653366 | 0.71 | — | — | |
| Butane SCHEMBL3052765 | 0.71 | — | — |
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-2004074333-A2 | PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES | DOW GLOBAL TECHNOLOGIES INC. (US) | 2004-09-02 | — | — | WO | disclosed |