⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL111139 | 0.78 | — | — | |
| SCHEMBL7719614 | 0.74 | — | — | |
| SCHEMBL5760574 | 0.73 | — | — | |
| SCHEMBL6714807 | 0.72 | GAA (0.38) | — | |
| SCHEMBL5804898 | 0.72 | — | — | |
| SCHEMBL14307082 | 0.72 | — | — | |
| SCHEMBL27393695 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL8107688 | 0.70 | — | — | |
| SCHEMBL7715888 | 0.68 | — | — | |
| SCHEMBL766750 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6380452-B1 | USING A FLUORINATED POLYETHERSULFONE POLYMER | UOP LLC | 2002-04-30 | — | — | US | disclosed |
| US-6281405-B1 | PASSING ALKYLATING AGENT AND ALKYLATION SUBSTRATE TO ALKYLATION REACTION ZONE, ALKYLATING SUBSTRATE WITH ALKYLATING PASSING PORTION OF REACTION EFFLUENT STREAM TO A PRODUCT SEPARATION ZONE OPERATING AT CONDITIONS TO SEPA | UOP LLC | 2001-08-28 | — | — | US | disclosed |
| US-6248931-B1 | USING A SULFONATED HEXAFLURO BIS-A-POLYETHER SULFONE MEMBRANE | UOP LLC | 2001-06-19 | — | — | US | disclosed |