⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5868583 | 0.68 | — | — | |
| SCHEMBL8623591 | 0.67 | — | — | |
| SCHEMBL278234 | 0.63 | — | — | |
| SCHEMBL10345940 | 0.62 | — | — | |
| SCHEMBL29916509 | 0.62 | — | — | |
| SCHEMBL18237800 | 0.59 | — | — | |
| SCHEMBL20381623 | 0.58 | — | — | |
| SCHEMBL460768 | 0.56 | GAA (0.44) | — | |
| SCHEMBL475129 | 0.55 | — | — | |
| SCHEMBL2001087 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7026313-B2 | 2-thia-1,6,8-triaza-naphthalene-2,2-dioxides are kinase inhibitors | WARNER-LAMBERT COMPANY (US) | 2006-04-11 | — | — | US | disclosed |
| US-7026313-B2 | 2-thia-1,6,8-triaza-naphthalene-2,2-dioxides are kinase inhibitors | WARNER-LAMBERT COMPANY (US) | 2006-04-11 | — | — | US | disclosed |
| US-20030186973-A1 | 2-Thia-1,6,8-Triaza-Naphthalene-2,2-Dioxides are kinase inhibitors | REPINE JOSEPH THOMAS (US) | 2003-10-02 | — | — | US | disclosed |
| US-20030186973-A1 | 2-Thia-1,6,8-Triaza-Naphthalene-2,2-Dioxides are kinase inhibitors | REPINE JOSEPH THOMAS (US) | 2003-10-02 | — | — | US | disclosed |
| WO-2003062246-A1 | 2-THIA-1,6,8-TRIAZA-NAPHTALENE-2,2-DIOXIDES AS CDK INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2003-07-31 | — | — | WO | disclosed |
| WO-2003062246-A1 | 2-THIA-1,6,8-TRIAZA-NAPHTALENE-2,2-DIOXIDES AS CDK INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2003-07-31 | — | — | WO | disclosed |
| WO-2003062246-A1 | 2-THIA-1,6,8-TRIAZA-NAPHTALENE-2,2-DIOXIDES AS CDK INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2003-07-31 | — | — | WO | disclosed |