⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1276333 | 0.80 | PTGDR2 (0.32) | — | |
| SCHEMBL2951542 | 0.75 | NR5A2 (0.36) | — | |
| SCHEMBL2952154 | 0.75 | CYP3A4 (0.34) | — | |
| SCHEMBL2947052 | 0.73 | MEN1 (0.32) | — | |
| SCHEMBL31601473 | 0.72 | ALOX5 (0.34) | — | |
| SCHEMBL28972946 | 0.71 | TYR (0.36) | — | |
| SCHEMBL28669262 | 0.70 | PTGDR2 (0.32) | — | |
| SCHEMBL6741152 | 0.68 | — | — | |
| SCHEMBL2319289 | 0.68 | — | — | |
| SCHEMBL7099255 | 0.68 | ALDH1A1 (0.33) | — |
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-6612351-B1 | Reduced rolling resistance and heat build up; durability | THE GOODYEAR TIRE & RUBBER COMPANY | 2003-09-02 | — | — | US | claimed |
| US-6612351-B1 | Reduced rolling resistance and heat build up; durability | THE GOODYEAR TIRE & RUBBER COMPANY | 2003-09-02 | — | — | US | disclosed |