⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11805228 | 0.70 | — | — | |
| SCHEMBL31058189 | 0.67 | — | — | |
| SCHEMBL1387260 | 0.64 | — | — | |
| SCHEMBL8417923 | 0.64 | — | — | |
| SCHEMBL27475811 | 0.64 | — | — | |
| SCHEMBL9428003 | 0.64 | — | — | |
| SCHEMBL5999710 | 0.64 | — | — | |
| SCHEMBL4013073 | 0.64 | — | — | |
| SCHEMBL17613988 | 0.64 | — | — | |
| SCHEMBL8869471 | 0.64 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0983234-B1 | LEUKOTRIENE B 4 DERIVATIVES, IN PARTICULAR 7-METHYLCYCLOHEXYL-LTB 4 ANTAGONISTS | SCHERING AG (DE) | 2002-07-03 | — | — | EP | disclosed |
| US-5366984-A | Fungicides, insecticides | BASF AKTIENGESELLSCHAFT (DE) | 1994-11-22 | — | — | US | disclosed |
| US-5294628-A | Fungicides, insecticides, pesticides | BASF AKTIENGESELLSCHAFT (DE) | 1994-03-15 | — | — | US | disclosed |
| US-5250553-A | Fungicides; pesticides | BASF AKTIENGESELLSCHAFT (DE) | 1993-10-05 | — | — | US | disclosed |
| US-5166216-A | Fungicides, pesticides, insecticides | BASF AKTIENGESELLSCHAFT (DE) | 1992-11-24 | — | — | US | disclosed |
| EP-0069692-B1 | CARBACYCLINES, THEIR PREPARATION AND THERAPEUTICAL APPLICATION | SCHERING AKTIENGESELLSCHAFT (DE) | 1988-03-02 | — | — | EP | disclosed |
| EP-0057660-B1 | PROSTACYCLINE DERIVATIVES, THEIR PREPARATION AND APPLICATIONS AS MEDICINES | SCHERING AKTIENGESELLSCHAFT (DE) | 1985-08-21 | — | — | EP | disclosed |
| EP-0069692-A1 | Carbacyclines, their preparation and therapeutical application | SCHERING AKTIENGESELLSCHAFT (DE) | 1983-01-12 | — | — | EP | disclosed |
| EP-0057660-A2 | Prostacycline derivatives, their preparation and applications as medicines | SCHERING AKTIENGESELLSCHAFT (DE) | 1982-08-11 | — | — | EP | disclosed |
| EP-0011591-B1 | Prostane derivatives, their production and pharmaceutical compositions containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1982-06-30 | — | — | EP | disclosed |
| EP-0011591-A1 | Prostane derivatives, their production and pharmaceutical compositions containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1980-05-28 | — | — | EP | disclosed |