⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18106366 | 1.00 | — | — | |
| SCHEMBL3360214 | 0.78 | — | — | |
| SCHEMBL11256413 | 0.76 | — | — | |
| SCHEMBL11256410 | 0.76 | — | — | |
| SCHEMBL28803283 | 0.73 | TSHR (0.39) | — | |
| SCHEMBL24149379 | 0.73 | — | — | |
| SCHEMBL4937739 | 0.72 | — | — | |
| SCHEMBL714812 | 0.72 | — | — | |
| SCHEMBL714811 | 0.72 | — | — | |
| SCHEMBL6138152 | 0.69 | — | — |
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-6812294-B2 | LIQUID NITRILE RUBBER; AND A SULFUR OR SULFUR DONOR CURING AGENT | FREUDENBERG-NOK GENERAL PARTNERSHIP | 2004-11-02 | — | — | US | disclosed |
| US-20030131934-A1 | Solventless liquid nitrile compounds | FREUDENBERG-NOK GENERAL PARTNERSHIP | 2003-07-17 | — | — | US | disclosed |