⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7929838 | 0.87 | — | — | |
| SCHEMBL7927616 | 0.87 | — | — | |
| SCHEMBL30488672 | 0.86 | — | — | |
| SCHEMBL7932509 | 0.84 | — | — | |
| SCHEMBL17800752 | 0.84 | — | — | |
| SCHEMBL7926369 | 0.83 | — | — | |
| SCHEMBL30488690 | 0.81 | — | — | |
| SCHEMBL21049501 | 0.81 | — | — | |
| SCHEMBL15265848 | 0.81 | — | — | |
| SCHEMBL51414 | 0.79 | — | — |
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-11732115-B2 | Tire for vehicle wheels | PIRELLI TYRE S.P.A. (IT) | 2023-08-22 | — | — | US | disclosed |
| US-6229036-B1 | PRODUCED BY REACTING MERCAPTOSILANES WITH CHLOROSILANES; USED AS COUPLING AGENTS IN RUBBER MIXTURES | Degussa-Hüls Aktiengesellschaft (DE) | 2001-05-08 | — | — | US | disclosed |
| EP-0992505-A2 | Sulfanyl silanes | Degussa-Hüls Aktiengesellschaft (DE) | 2000-04-12 | — | — | EP | disclosed |