⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3229790 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL4420207 | 0.74 | MAPK1 (0.32) | — | |
| SCHEMBL16704701 | 0.72 | — | — | |
| SCHEMBL9428149 | 0.69 | USP2 (0.34) | — | |
| SCHEMBL5241702 | 0.69 | KDM4E (0.34) | — | |
| SCHEMBL1628831 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL17048382 | 0.69 | USP2 (0.34) | — | |
| SCHEMBL2962445 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL12150375 | 0.69 | — | — | |
| SCHEMBL3608074 | 0.69 | TSHR (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8022083-B2 | Antiviral phosphonate analogs | GILEAD SCIENCES, INC. (US) | 2011-09-20 | — | — | US | disclosed |
| US-20090275535-A1 | ANTIVIRAL PHOSPHONATE ANALOGS | GILEAD SCIENCES, INC. | 2009-11-05 | — | — | US | disclosed |
| US-7429565-B2 | Antiviral phosphonate analogs | GILEAD SCIENCES, INC. (US) | 2008-09-30 | — | — | US | disclosed |