⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5516435 | 0.69 | — | — | |
| SCHEMBL14491976 | 0.67 | — | — | |
| SCHEMBL25376451 | 0.64 | — | — | |
| SCHEMBL46409 | 0.64 | TSHR (0.32) | — | |
| Methylene Chloride SCHEMBL20357810 | 0.62 | — | — | |
| SCHEMBL28896574 | 0.62 | — | — | |
| SCHEMBL28584959 | 0.62 | TSHR (0.30) | — | |
| SCHEMBL14064604 | 0.60 | — | — | |
| SCHEMBL7949071 | 0.60 | — | — | |
| SCHEMBL14524703 | 0.60 | CYP19A1 (0.32) | — |
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-5376169-A | Nonaqueous solvent, pigment, resin and at least one additive from alginates and borneols | MINOLTA CAMERA KABUSHIKI KAISHA (JP) | 1994-12-27 | — | — | US | disclosed |