⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8667043 | 0.84 | L3MBTL1 (0.36) | — | |
| SCHEMBL700216 | 0.81 | — | — | |
| SCHEMBL4722361 | 0.78 | TP53 (0.33) | — | |
| SCHEMBL8668629 | 0.76 | SLC22A2 (0.37) | — | |
| SCHEMBL8658131 | 0.76 | HTR2A (0.36) | — | |
| SCHEMBL1045949 | 0.76 | TSHR (0.48) | — | |
| SCHEMBL8669538 | 0.76 | — | — | |
| SCHEMBL9307863 | 0.76 | — | — | |
| SCHEMBL6553728 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL127066 | 0.75 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1234007-B1 | OLIGOMERIC METHINE DYES | CLARIANT FINANCE BVI LTD (VG) | 2004-02-18 | — | — | EP | disclosed |
| EP-1234007-A1 | OLIGOMERIC METHINE DYES | Clariant Finance (BVI) Limited (VG) | 2002-08-28 | — | — | EP | disclosed |
| WO-2001036543-A1 | OLIGOMERIC METHINE DYES | CLARIANT FINANCE (BVI) LIMITED (VG) | 2001-05-25 | — | — | WO | disclosed |