⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23900890 | 0.89 | MEN1 (0.40) | — | |
| SCHEMBL8909834 | 0.87 | MEN1 (0.35) | — | |
| SCHEMBL25145418 | 0.86 | — | — | |
| SCHEMBL24337247 | 0.84 | — | — | |
| SCHEMBL24065135 | 0.78 | — | — | |
| SCHEMBL2737210 | 0.78 | CA12 (0.44) | — | |
| SCHEMBL21955607 | 0.78 | HTR2A (0.31) | — | |
| SCHEMBL24424824 | 0.78 | CA12 (0.44) | — | |
| SCHEMBL10289401 | 0.78 | CA12 (0.44) | — | |
| SCHEMBL27278719 | 0.77 | MEN1 (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20260028445-A1 | AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS | EVONIK OPERATIONS GMBH (DE) | 2026-01-29 | — | — | US | disclosed |
| EP-4253442-A2 | AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS | Evonik Operations GmbH (DE) | 2023-10-04 | — | — | EP | disclosed |
| EP-4253442-A2 | AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS | Evonik Operations GmbH (DE) | 2023-10-04 | — | — | EP | disclosed |
| US-20220144996-A1 | AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS | EVONIK OPERATIONS GMBH (DE) | 2022-05-12 | — | — | US | disclosed |
| US-20220144996-A1 | AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS | EVONIK OPERATIONS GMBH (DE) | 2022-05-12 | — | — | US | disclosed |