⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14947111 | 0.83 | MEN1 (0.33) | — | |
| SCHEMBL13298022 | 0.81 | TSHR (0.38) | — | |
| SCHEMBL12109577 | 0.80 | MEN1 (0.31) | — | |
| SCHEMBL1625511 | 0.79 | ADRA2A (0.31) | — | |
| SCHEMBL13246440 | 0.77 | DGKA (0.34) | — | |
| SCHEMBL18534169 | 0.77 | HTR2C (0.32) | — | |
| SCHEMBL16368650 | 0.75 | MEN1 (0.32) | — | |
| SCHEMBL11142688 | 0.75 | GAA (0.32) | — | |
| SCHEMBL16371608 | 0.74 | TSHR (0.43) | — | |
| SCHEMBL16371269 | 0.72 | GAA (0.31) | — |
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-8158212-B2 | Ink composition, inkjet recording method, and printed material | FUJIFILM CORPORATION (JP) | 2012-04-17 | — | — | US | disclosed |
| US-20080286484-A1 | INK COMPOSITION, INKJET RECORDING METHOD, AND PRINTED MATERIAL | FUJIFILM CORPORATION (JP) | 2008-11-20 | — | — | US | disclosed |