⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL307120 | 0.87 | CYP4F2 (0.37) | — | |
| SCHEMBL11651264 | 0.80 | TAAR1 (0.47) | — | |
| SCHEMBL3341059 | 0.79 | CYP4F2 (0.33) | — | |
| SCHEMBL22245281 | 0.79 | TAAR1 (0.47) | — | |
| SCHEMBL16669513 | 0.79 | HTR1A (0.46) | — | |
| SCHEMBL11600164 | 0.79 | ALDH1A1 (0.40) | — | |
| SCHEMBL1972956 | 0.77 | TAAR1 (0.53) | — | |
| SCHEMBL2783361 | 0.76 | MTNR1A (0.44) | — | |
| Ethylene SCHEMBL27576641 | 0.76 | ALDH1A1 (0.38) | — | |
| SCHEMBL339625 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0994150-B1 | Preparation of reinforced rubber | GOODYEAR TIRE & RUBBER (US) | 2004-03-24 | — | — | EP | claimed |
| US-6384127-B2 | MIXTURE CONTAINING ORGANOSILANE DISULFIDE COMPOUND | THE GOODYEAR TIRE & RUBBER COMPANY | 2002-05-07 | — | — | US | claimed |
| US-20010034392-A1 | Preparation of reinforced rubber and use in tires | THE GOODYEAR TIRE & RUBBER COMPANY | 2001-10-25 | — | — | US | claimed |
| EP-0994150-A1 | Preparation of reinforced rubber | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 2000-04-19 | — | — | EP | claimed |