⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1591984 | 0.87 | — | — | |
| SCHEMBL12701557 | 0.87 | — | — | |
| SCHEMBL25608885 | 0.80 | P2RY6 (0.33) | — | |
| SCHEMBL12723047 | 0.79 | ALDH1A1 (0.31) | — | |
| SCHEMBL15209696 | 0.79 | — | — | |
| SCHEMBL31438680 | 0.75 | — | — | |
| SCHEMBL18034297 | 0.75 | — | — | |
| SCHEMBL1078117 | 0.74 | — | — | |
| SCHEMBL1078788 | 0.74 | — | — | |
| SCHEMBL13715793 | 0.73 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8431588-B2 | Cyclopropyl polymerase inhibitors | JANSSEN PRODUCTS, LP (US) | 2013-04-30 | — | — | US | disclosed |
| US-8431588-B2 | Cyclopropyl polymerase inhibitors | JANSSEN PRODUCTS, LP (US) | 2013-04-30 | — | — | US | disclosed |
| EP-2141172-B1 | Cyclopropyl polymerase inhibitors | JANSSEN PRODUCTS LP (US) | 2012-10-24 | — | — | EP | disclosed |
| US-20110092460-A1 | CYCLOPROPYL POLYMERASE INHIBITORS | CENTOCOR ORTHO BIOTECH PRODUCTS L.P. (US) | 2011-04-21 | — | — | US | disclosed |
| US-20110092460-A1 | CYCLOPROPYL POLYMERASE INHIBITORS | CENTOCOR ORTHO BIOTECH PRODUCTS L.P. (US) | 2011-04-21 | — | — | US | disclosed |
| EP-2141172-A1 | Cyclopropyl polymerase inhibitors | Ortho Biotech Products L.P. (US) | 2010-01-06 | — | — | EP | disclosed |