⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12460250 | 0.83 | — | — | |
| SCHEMBL2594264 | 0.71 | — | — | |
| SCHEMBL28172773 | 0.67 | — | — | |
| SCHEMBL14447406 | 0.65 | — | — | |
| SCHEMBL6587637 | 0.65 | — | — | |
| SCHEMBL4620921 | 0.65 | — | — | |
| SCHEMBL27928433 | 0.65 | — | — | |
| SCHEMBL11980671 | 0.65 | — | — | |
| SCHEMBL17293370 | 0.65 | — | — | |
| SCHEMBL10581331 | 0.63 | — | — |
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-20030100703-A1 | Process for the preparation of polymeric sulfur compounds | BAYER AKTIENGESELLSCHAFT (DE) | 2003-05-29 | — | — | US | disclosed |
| US-6319993-B2 | POLYMERIC CYCLOPENTANE POLYSULFIDES AND THEIR PREPARATION FOR DICYCLOPENTENYL POLYSULFIDES, SULFUR AND HYDROGEN SULFIDE; LOW COST REVERSION STABILIZERS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-11-20 | — | — | US | disclosed |
| US-20010029290-A1 | Vulcanizing agents for unsaturated rubber mixtures | LANXESS DEUTSCHLAND GMBH (DE) | 2001-10-11 | — | — | US | disclosed |