⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7863912 | 0.73 | — | — | |
| SCHEMBL2396970 | 0.73 | — | — | |
| SCHEMBL11288898 | 0.71 | — | — | |
| SCHEMBL27402337 | 0.71 | — | — | |
| SCHEMBL7863913 | 0.69 | — | — | |
| SCHEMBL1652664 | 0.69 | — | — | |
| SCHEMBL4133707 | 0.69 | — | — | |
| SCHEMBL7473815 | 0.69 | — | — | |
| SCHEMBL16769085 | 0.67 | ALDH1A1 (0.35) | — | |
| SCHEMBL17385736 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4210345-A | Pressure-sensitive recording or copying material | CIBA-GEIGY CORPORATION (US) | 1980-07-01 | — | — | US | claimed |
| US-4202566-A | AN ALDEHYDE REACTION PRODUCT WITH AN ALCOHOL AS COLOR DEVELOPER | CIBA-GEIGY CORPORATION (US) | 1980-05-13 | — | — | US | claimed |
| US-4324420-A | HAVING AN ALDEHYDE REACTION PRODUCT AS DEVELOPER | CIBA-GEIGY CORPORATION (US) | 1982-04-13 | — | — | US | disclosed |
| US-4210345-A | Pressure-sensitive recording or copying material | CIBA-GEIGY CORPORATION (US) | 1980-07-01 | — | — | US | disclosed |
| US-4202566-A | AN ALDEHYDE REACTION PRODUCT WITH AN ALCOHOL AS COLOR DEVELOPER | CIBA-GEIGY CORPORATION (US) | 1980-05-13 | — | — | US | disclosed |