⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6023366 | 0.95 | — | — | |
| SCHEMBL2303916 | 0.95 | — | — | |
| SCHEMBL1771223 | 0.95 | — | — | |
| SCHEMBL16695 | 0.95 | — | — | |
| Formaldehyde SCHEMBL29150621 | 0.93 | — | — | |
| Formaldehyde SCHEMBL29150620 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL680119 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL2771470 | 0.92 | — | — | |
| Bromide SCHEMBL3725573 | 0.92 | — | — | |
| Iodide SCHEMBL15515859 | 0.92 | — | — |
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-5744436-A | MIXTURE OF PERFLUORO-N-METHYLMORPHOLINE AND 1,1-DICHLORO-1-FLUOROETHANE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1998-04-28 | — | — | US | disclosed |