⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10099049 | 0.75 | CDK2 (0.38) | — | |
| SCHEMBL16854926 | 0.61 | MEN1 (0.41) | — | |
| SCHEMBL20089642 | 0.60 | ALDH1A1 (0.31) | — | |
| SCHEMBL1039206 | 0.59 | ALDH1A1 (0.38) | — | |
| SCHEMBL14012060 | 0.58 | — | — | |
| SCHEMBL14012059 | 0.57 | CYP2A6 (0.30) | — | |
| SCHEMBL8562919 | 0.57 | NQO1 (0.48) | — | |
| SCHEMBL20527755 | 0.56 | — | — | |
| SCHEMBL9111436 | 0.55 | — | — | |
| SCHEMBL14502973 | 0.54 | ALDH1A1 (0.34) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8420297-B2 | Developers and method of coloring lithographic printing members | EASTMAN KODAK COMPANY (US) | 2013-04-16 | — | — | US | disclosed |
| US-8420297-B2 | Developers and method of coloring lithographic printing members | EASTMAN KODAK COMPANY (US) | 2013-04-16 | — | — | US | disclosed |
| US-20120045720-A1 | DEVELOPERS AND METHOD OF COLORING LITHOGRAPHIC PRINTING MEMBERS | KODAK REALTY INC. | 2012-02-23 | — | — | US | disclosed |
| US-20120045720-A1 | DEVELOPERS AND METHOD OF COLORING LITHOGRAPHIC PRINTING MEMBERS | KODAK REALTY INC. | 2012-02-23 | — | — | US | disclosed |