⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4875592 | 0.74 | — | — | |
| SCHEMBL19924966 | 0.70 | — | — | |
| SCHEMBL16370098 | 0.67 | — | — | |
| SCHEMBL10488764 | 0.64 | — | — | |
| Propene SCHEMBL10882461 | 0.60 | — | — | |
| Vinyl Chloride SCHEMBL11465597 | 0.60 | — | — | |
| Propene SCHEMBL7794432 | 0.60 | ALDH1A1 (0.33) | — | |
| SCHEMBL649877 | 0.56 | — | — | |
| SCHEMBL517992 | 0.53 | — | — | |
| SCHEMBL18029791 | 0.53 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0379305-B1 | Low odor adhesive compositions | MINNESOTA MINING & MFG (US) | 1994-05-11 | — | — | EP | disclosed |
| US-4945006-A | UNSATURATED CYCLIC AMIDES, ANAEROBIC PROCESS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1990-07-31 | — | — | US | disclosed |
| EP-0379305-A1 | Low odor adhesive compositions | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1990-07-25 | — | — | EP | disclosed |
| US-4914206-A | ANTIBIOTICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-04-03 | — | — | US | disclosed |