⚠ 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL11260489 | 0.97 | — | — | |
| SCHEMBL15101128 | 0.79 | — | — | |
| SCHEMBL9491675 | 0.76 | ALDH1A1 (0.41) | — | |
| SCHEMBL22130034 | 0.73 | ALDH1A1 (0.41) | — | |
| SCHEMBL379153 | 0.73 | — | — | |
| SCHEMBL7769296 | 0.73 | — | — | |
| SCHEMBL220407 | 0.71 | — | — | |
| SCHEMBL29088267 | 0.71 | — | — | |
| SCHEMBL30564576 | 0.71 | ALDH1A1 (0.39) | — | |
| Hydrochloric Acid SCHEMBL9004846 | 0.71 | — | — |
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-20250243238-A1 | TETRAZINE AMINO ACIDS AND METHODS FOR THEIR PRODUCTION AND USE | OREGON STATE UNIVERSITY (US) | 2025-07-31 | — | — | US | disclosed |
| EP-2253673-B1 | AZO COMPOUND, AZO PIGMENT, AND DISPERSION, COLORED COMPOSITION, INK-JET RECORDING INK, INK-JET RECORDING INK TANK, INK-JET RECORDING METHOD AND RECORDED MATERIAL EACH CONTAINING THE AZO COMPOUND OR THE AZO PIGMENT | FUJIFILM CORP (JP) | 2015-11-11 | — | — | EP | disclosed |
| US-20130178437-A1 | CONJUGATES COMPRISING HYDROXYALKYL STARCH AND A CYTOTOXIC AGENT AND PROCESS FOR THEIR PREPARATION | FRESENIUS KABI DEUTSCHLAND GMBH (DE) | 2013-07-11 | — | — | US | disclosed |
| WO-2012004007-A1 | CONJUGATES COMPRISING HYDROXYALKYL STARCH AND A CYTOTOXIC AGENT AND PROCESS FOR THEIR PREPARATION | FRESENIUS KABI DEUTSCHLAND GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |
| US-5574140-A | LABELS FOR TARGETS MOLECULES FOR DIAGNOSIS | RESOLUTION PHARMACEUTICAL INC. (CA) | 1996-11-12 | — | — | US | disclosed |
| US-4846881-A | AMINO OR THIO DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-07-11 | — | — | US | disclosed |
| EP-0284901-A1 | 3,4,6-Trisubstituted 1,2,4-triazin-5(4H)-ones | BAYER AG (DE) | 1988-10-05 | — | — | EP | disclosed |