⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL524135 | 0.77 | — | — | |
| SCHEMBL1316316 | 0.77 | — | — | |
| SCHEMBL29432826 | 0.74 | — | — | |
| SCHEMBL3340262 | 0.74 | — | — | |
| SCHEMBL29548075 | 0.74 | — | — | |
| SCHEMBL2692217 | 0.67 | — | — | |
| SCHEMBL210649 | 0.63 | — | — | |
| SCHEMBL5933484 | 0.59 | — | — | |
| SCHEMBL3725331 | 0.56 | — | — | |
| SCHEMBL6049955 | 0.55 | CASP1 (0.33) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009036790-A1 | PRIMER COMPOSITIONS FOR ADHESIVE BONDING SYSTEMS AND COATINGS | HENKEL AG & CO. KGAA (DE) | 2009-03-26 | — | — | WO | claimed |
| WO-2005003408-A2 | PIGMENT GRADE CORROSION INHIBITOR HOST-GUEST COMPOSITIONS AND PROCEDURE | WAYNE PIGMENT CORP. (US) | 2005-01-13 | — | — | WO | claimed |
| WO-1999018044-A1 | HYBRID PIGMENT GRADE CORROSION INHIBITOR COMPOSITIONS AND PROCEDURES | WAYNE PIGMENT CORP. (US) | 1999-04-15 | — | — | WO | claimed |
| CN-119698447-A | Crosslinking agent for chlorinated butyl rubber | 川口化学工业株式会社 | 2025-03-25 | — | — | CN | disclosed |
| JP-2006265119-A | METHOD FOR PRODUCING AMINOTRIAZINEDITHIOL COMPOUND | NIPPON STEEL CHEM CO LTD | 2006-10-05 | — | — | JP | disclosed |
| WO-2005003408-A2 | PIGMENT GRADE CORROSION INHIBITOR HOST-GUEST COMPOSITIONS AND PROCEDURE | WAYNE PIGMENT CORP. (US) | 2005-01-13 | — | — | WO | disclosed |
| WO-2002092880-A1 | CORROSION INHIBITOR COMPOSITION APPLICABLE FOR ALUMINUM AND STEEL PROTECTION AND PROCEDURE | WAYNE PIGMENT CORPORATION (US) | 2002-11-21 | — | — | WO | disclosed |
| US-3969349-A | Vulcanization of rubber with phosphoro triazine sulfides | MONSANTO COMPANY (US) | 1976-07-13 | — | — | US | disclosed |