⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10967329 | 1.00 | — | — | |
| SCHEMBL14612460 | 0.81 | — | — | |
| SCHEMBL22295552 | 0.81 | — | — | |
| SCHEMBL20343563 | 0.77 | — | — | |
| SCHEMBL3060455 | 0.75 | ADH1B (0.46) | — | |
| SCHEMBL905748 | 0.75 | ADH1B (0.46) | — | |
| SCHEMBL20713597 | 0.73 | — | — | |
| SCHEMBL170579 | 0.73 | EPHX1 (0.48) | — | |
| SCHEMBL170578 | 0.73 | EPHX1 (0.48) | — | |
| SCHEMBL15182725 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4496727-A | ORGANIC PIGMENTS; PLASTICS; LACQUERS; INKS; COATINGS; COLOR FASTNESS | CIBA-GEIGY CORPORATION (US) | 1985-01-29 | — | — | US | disclosed |
| US-4385174-A | FOR PIGMENTS | CIBA-GEIGY CORPORATION (US) | 1983-05-24 | — | — | US | disclosed |