⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7165590 | 0.75 | TSHR (0.42) | — | |
| SCHEMBL237697 | 0.74 | — | — | |
| SCHEMBL10735776 | 0.73 | — | — | |
| SCHEMBL3797121 | 0.72 | — | — | |
| SCHEMBL10358481 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL8398642 | 0.70 | — | — | |
| SCHEMBL14175630 | 0.67 | TP53 (0.42) | — | |
| SCHEMBL24410082 | 0.67 | TP53 (0.30) | — | |
| SCHEMBL3851227 | 0.67 | TSHR (0.50) | — | |
| SCHEMBL10358028 | 0.65 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1476576-B1 | FLUOROGENIC DYES | NOVARTIS VACCINES & DIAGNOSTIC (US) | 2008-10-29 | — | — | EP | disclosed |
| EP-1476576-A4 | FLUOROGENIC DYES | CHIRON CORP (US) | 2006-05-17 | — | — | EP | disclosed |
| EP-1476576-A2 | FLUOROGENIC DYES | CHIRON CORPORATION (US) | 2004-11-17 | — | — | EP | disclosed |
| WO-2003062451-A2 | FLUOROGENIC DYES | CHIRON CORPORATION (US) | 2003-07-31 | — | — | WO | disclosed |
| EP-0229007-B1 | ANTICONVULSANT GAMMA-THIOBUTYROLACTONE DERIVATIVES | WASHINGTON UNIVERSITY (US) | 1990-11-28 | — | — | EP | disclosed |
| US-4707491-A | Anticonvulsant γ-thiobutyrolactone derivatives | WASHINGTON UNIVERSITY (US) | 1987-11-17 | — | — | US | disclosed |
| EP-0229007-A1 | Anticonvulsant gamma-thiobutyrolactone derivatives | WASHINGTON UNIVERSITY (US) | 1987-07-15 | — | — | EP | disclosed |