⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19478198 | 0.78 | — | — | |
| SCHEMBL16814737 | 0.75 | — | — | |
| SCHEMBL20806034 | 0.73 | — | — | |
| SCHEMBL20624124 | 0.73 | — | — | |
| SCHEMBL20806029 | 0.70 | — | — | |
| SCHEMBL22807655 | 0.70 | — | — | |
| SCHEMBL15315253 | 0.66 | LMNA (0.34) | — | |
| SCHEMBL19723359 | 0.66 | GBA1 (0.36) | — | |
| SCHEMBL20805926 | 0.66 | NOTUM (0.43) | — | |
| SCHEMBL22916947 | 0.63 | SMYD3 (0.40) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9764068-B2 | Immobilised biological entities | W.L. GORE AND ASSOCIATES INC. (US) | 2017-09-19 | — | — | US | disclosed |