⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7588618 | 0.81 | — | — | |
| SCHEMBL2328690 | 0.81 | ADRB2 (0.32) | — | |
| SCHEMBL2325641 | 0.81 | — | — | |
| SCHEMBL5590960 | 0.80 | — | — | |
| SCHEMBL5378172 | 0.79 | MEN1 (0.31) | — | |
| SCHEMBL2328993 | 0.77 | — | — | |
| SCHEMBL6053372 | 0.75 | — | — | |
| SCHEMBL2328472 | 0.75 | — | — | |
| SCHEMBL2328650 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL2324733 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2007254366-A | TETRAALKYLDIALKOXYDISTANNOXANE | ASAHI KASEI CHEMICALS CORP | 2007-10-04 | — | — | JP | disclosed |