⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3338127 | 0.69 | — | — | |
| SCHEMBL17069792 | 0.59 | NOTUM (0.39) | — | |
| SCHEMBL9465196 | 0.59 | MAPT (0.46) | — | |
| SCHEMBL2502136 | 0.58 | — | — | |
| SCHEMBL1827788 | 0.57 | — | — | |
| SCHEMBL5602945 | 0.57 | TDP1 (0.33) | — | |
| SCHEMBL3601974 | 0.56 | ALDH1A1 (0.38) | — | |
| SCHEMBL9465439 | 0.55 | — | — | |
| SCHEMBL9466069 | 0.55 | PTK2 (0.41) | — | |
| SCHEMBL9465420 | 0.55 | KDM4A (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110245156-A1 | NOVEL ANTIVIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | CYTOKINE PHARMASCIENCES, INC. (US) | 2011-10-06 | — | — | US | claimed |
| US-20110245156-A1 | NOVEL ANTIVIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | CYTOKINE PHARMASCIENCES, INC. (US) | 2011-10-06 | — | — | US | disclosed |