⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL56534 | 0.84 | — | — | |
| SCHEMBL380860 | 0.83 | LMNA (0.30) | — | |
| SCHEMBL56266 | 0.83 | — | — | |
| SCHEMBL8724962 | 0.81 | — | — | |
| SCHEMBL14775581 | 0.78 | LMNA (0.39) | — | |
| SCHEMBL333838 | 0.78 | — | — | |
| SCHEMBL8526661 | 0.76 | — | — | |
| SCHEMBL5491025 | 0.76 | LMNA (0.43) | — | |
| SCHEMBL9203118 | 0.76 | — | — | |
| SCHEMBL7750658 | 0.76 | — | — |
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-5530063-A | HIGH-STRENGTH ADHESIVE COMPRISING A POLYSILOXANE HAVING END-GROUPS, AN ADDITION POLYMER, AN EPOXY COMPOUND, A CURING AGENT AND A CURING CATALYST | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-06-25 | — | — | US | disclosed |