⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14144574 | 0.87 | — | — | |
| SCHEMBL13814714 | 0.75 | — | — | |
| SCHEMBL13814765 | 0.73 | — | — | |
| SCHEMBL8267538 | 0.72 | — | — | |
| SCHEMBL13956948 | 0.72 | — | — | |
| SCHEMBL22036017 | 0.71 | — | — | |
| SCHEMBL13814711 | 0.70 | — | — | |
| SCHEMBL13818545 | 0.69 | — | — | |
| SCHEMBL13818680 | 0.69 | — | — | |
| SCHEMBL20842855 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009077186-A1 | NONSTEROIDAL PROGESTERONE RECEPTOR MODULATORS | BAYER SCHERING PHARMA AKTIENGESLLSCHAFT (DE) | 2009-06-25 | — | — | WO | disclosed |
| WO-2008077647-A2 | ALPHA- AMINO ALCOHOLS AS NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-07-03 | — | — | WO | disclosed |