⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL812136 | 0.76 | — | — | |
| SCHEMBL4239654 | 0.74 | — | — | |
| SCHEMBL15626616 | 0.74 | — | — | |
| SCHEMBL6510174 | 0.74 | — | — | |
| SCHEMBL15314542 | 0.74 | — | — | |
| SCHEMBL11221005 | 0.73 | ZDHHC20 (0.44) | — | |
| SCHEMBL1890045 | 0.72 | TSHR (0.40) | — | |
| Acrylic Acid SCHEMBL15238235 | 0.70 | LMNA (0.56) | — | |
| Acrylic Acid SCHEMBL2571775 | 0.70 | LMNA (0.56) | — | |
| Acrylic Acid SCHEMBL767124 | 0.70 | LMNA (0.56) | — |
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-20030162179-A1 | Fabrication, performance testing, and screening of three dimensional arrays of materials | GENERAL ELECTRIC COMPANY | 2003-08-28 | — | — | US | disclosed |