⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3417138 | 0.86 | SIRT2 (0.44) | — | |
| SCHEMBL29001114 | 0.85 | — | — | |
| SCHEMBL25397359 | 0.85 | SIRT2 (0.39) | — | |
| SCHEMBL3417894 | 0.84 | — | — | |
| SCHEMBL3421658 | 0.80 | ALDH1A1 (0.35) | — | |
| SCHEMBL888651 | 0.80 | — | — | |
| SCHEMBL7263919 | 0.80 | — | — | |
| SCHEMBL28800498 | 0.80 | — | — | |
| SCHEMBL7264368 | 0.80 | — | — | |
| SCHEMBL7262983 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109843935-B | Dispersion liquid | 住友化学株式会社 | 2021-07-27 | — | — | CN | disclosed |
| US-20100302330-A1 | IMAGE FORMATION METHOD AND ACTIVE ENERGY BEAM-CURABLE INK | RISO KAGAKU CORPORATION (JP) | 2010-12-02 | — | — | US | disclosed |
| US-20100130712-A1 | ADAMANTANE DERIVATIVE, RESIN COMPOSITION USING THE SAME, AND RESIN CURED PRODUCT | IDEMITSU KOSAN CO., LTD. (JP) | 2010-05-27 | — | — | US | disclosed |
| US-20040214945-A1 | Catioinically polymerizable composition and ink | RISO KAGAKU CORPORATION (JP) | 2004-10-28 | — | — | US | disclosed |
| CN-1030759-A | Agricultural chemical compound | WELLCOME FOUND (GB) | 1989-02-01 | — | — | CN | disclosed |