⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL83932 | 0.76 | — | — | |
| SCHEMBL30094371 | 0.76 | — | — | |
| SCHEMBL931602 | 0.67 | — | — | |
| SCHEMBL28738743 | 0.67 | — | — | |
| SCHEMBL15403862 | 0.67 | — | — | |
| SCHEMBL7515078 | 0.65 | — | — | |
| SCHEMBL477951 | 0.64 | — | — | |
| SCHEMBL10784385 | 0.64 | — | — | |
| SCHEMBL477901 | 0.64 | — | — | |
| SCHEMBL477960 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120328518-A1 | PROSTATE SPECIFIC MEMBRANE ANTIGEN INHIBITORS | PIRAMAL IMAGING SA (CH) | 2012-12-27 | — | — | US | disclosed |
| EP-2513121-A1 | PROSTATE SPECIFIC MEMBRANE ANTIGEN INHIBITORS | Piramal Imaging SA (CH) | 2012-10-24 | — | — | EP | disclosed |
| EP-2338892-A1 | Prostate specific membrane antigen inhibitors | Bayer Schering Pharma Aktiengesellschaft (DE) | 2011-06-29 | — | — | EP | disclosed |
| WO-2011073286-A1 | PROSTATE SPECIFIC MEMBRANE ANTIGEN INHIBITORS | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2011-06-23 | — | — | WO | disclosed |