⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11529906 | 0.82 | PTPN1 (0.41) | — | |
| SCHEMBL8906097 | 0.79 | MMP1 (0.32) | — | |
| SCHEMBL3740634 | 0.74 | FDPS (0.30) | — | |
| SCHEMBL337595 | 0.71 | MMP1 (0.34) | — | |
| SCHEMBL18759662 | 0.70 | CYP4F2 (0.40) | — | |
| SCHEMBL16048 | 0.70 | CYP4F2 (0.40) | — | |
| SCHEMBL9578846 | 0.70 | FDPS (0.32) | — | |
| SCHEMBL97930 | 0.68 | DGAT1 (0.39) | — | |
| SCHEMBL19278938 | 0.68 | CYP4F2 (0.39) | — | |
| SCHEMBL413276 | 0.68 | CYP4F2 (0.39) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030220315-A1 | Alkenyldiarylmethane non-nucleoside HIV-1 reverse transcriptase inhibitors | CUSHMAN MARK S (US) | 2003-11-27 | — | — | US | disclosed |
| EP-1047656-A4 | ALKENYLDIARYLMETHANE NON-NUCLEOSIDE HIV-1 REVERSE TRANSCRIPTASE INHIBITORS | PURDUE RESEARCH FOUNDATION (US) | 2003-07-30 | — | — | EP | disclosed |
| US-6569897-B1 | Such as 3',3\"-dibromo-4',4\"-dimethyoxy-5',5\"-bis(methyoxy carbonyl)-1,1-diphenylethene | PURDUE RESEARCH FOUNDATION | 2003-05-27 | — | — | US | disclosed |
| EP-1047656-A1 | ALKENYLDIARYLMETHANE NON-NUCLEOSIDE HIV-1 REVERSE TRANSCRIPTASE INHIBITORS | PURDUE RESEARCH FOUNDATION (US) | 2000-11-02 | — | — | EP | disclosed |
| WO-1999036384-A1 | ALKENYLDIARYLMETHANE NON-NUCLEOSIDE HIV-1 REVERSE TRANSCRIPTASE INHIBITORS | PURDUE RESEARCH FOUNDATION (US) | 1999-07-22 | — | — | WO | disclosed |