⚠ 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 | |
|---|---|---|---|---|
| Tetrahydrofuran SCHEMBL9842785 | 1.00 | — | — | |
| Tetrahydrofuran SCHEMBL27287534 | 1.00 | — | — | |
| Tetrahydrofuran SCHEMBL11115602 | 0.95 | — | — | |
| SCHEMBL8433168 | 0.95 | — | — | |
| Tetrahydrofuran SCHEMBL4109737 | 0.95 | — | — | |
| Tetrahydrofuran SCHEMBL10408382 | 0.95 | — | — | |
| SCHEMBL28035856 | 0.95 | — | — | |
| SCHEMBL9576477 | 0.94 | ALDH1A1 (1.00) | — | |
| Tetrahydrofuran SCHEMBL130914 | 0.94 | — | — | |
| SCHEMBL30432886 | 0.94 | ALDH1A1 (1.00) | — |
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-20090209715-A1 | Process for producing polymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-08-20 | — | — | US | disclosed |
| EP-1892258-A1 | PROCESS FOR PRODUCING POLYMER | Sumitomo Chemical Company, Limited (JP) | 2008-02-27 | — | — | EP | disclosed |