⚠ 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 | |
|---|---|---|---|---|
| Methylamine SCHEMBL22022513 | 0.97 | FDPS (0.32) | — | |
| Azetidine SCHEMBL6908996 | 0.87 | — | — | |
| SCHEMBL6483061 | 0.78 | — | — | |
| SCHEMBL3194507 | 0.78 | FDPS (0.36) | — | |
| SCHEMBL705105 | 0.78 | — | — | |
| SCHEMBL19463073 | 0.75 | OPRM1 (0.32) | — | |
| SCHEMBL1035795 | 0.75 | — | — | |
| SCHEMBL5010458 | 0.75 | ALDH1A1 (0.31) | — | |
| SCHEMBL613324 | 0.74 | — | — | |
| SCHEMBL18856208 | 0.74 | FDPS (0.33) | — |
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-20040197484-A1 | Coating liquid for forming insulating film and method for producing insulating film | SUMITOMO CHEMICAL COMPANY, LIMITED | 2004-10-07 | — | — | US | disclosed |