⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4935611 | 0.74 | — | — | |
| SCHEMBL27938332 | 0.69 | — | — | |
| SCHEMBL8773907 | 0.69 | — | — | |
| SCHEMBL5229482 | 0.67 | TDP1 (0.42) | — | |
| SCHEMBL27881416 | 0.67 | — | — | |
| SCHEMBL9572897 | 0.67 | — | — | |
| Isopropyl Alcohol SCHEMBL7739794 | 0.65 | — | — | |
| SCHEMBL1573116 | 0.65 | — | — | |
| SCHEMBL3927423 | 0.65 | — | — | |
| Dihydroxyacetone SCHEMBL167719 | 0.62 | TDP1 (0.30) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4308551-A1 | NEW CONTRAST AGENT FOR USE IN MAGNETIC RESONANCE IMAGING | Bayer Aktiengesellschaft (DE) | 2024-01-24 | — | — | EP | disclosed |
| WO-2023111396-A1 | PHARMACEUTICAL COMPOSITION COMPRISING P-BORONOPHENYLALANINE | TENBORON OY (FI) | 2023-06-22 | — | — | WO | disclosed |
| WO-2022181381-A1 | ORGANIC AMMONIUM SALT HAVING PHOSPHONATE OR PHOSPHINATE ANION, AND COMPOSITION WHICH IS CAPABLE OF FORMING SAID SALT | ミヨシ油脂株式会社 | 2022-09-01 | — | — | WO | disclosed |
| WO-2021256448-A1 | ADDITIVE OR COMPOSITION FOR IMPARTING LUBRICITY | ミヨシ油脂株式会社 | 2021-12-23 | — | — | WO | disclosed |
| WO-2021095398-A1 | ORGANIC AMMONIUM SALT AND HYDROGEN BOND MATERIAL TREATING AGENT USING SAME | ミヨシ油脂株式会社 | 2021-05-20 | — | — | WO | disclosed |
| WO-2020166674-A1 | COMPOSITION CONTAINING ORGANIC AMMONIUM SALT | ミヨシ油脂株式会社 | 2020-08-20 | — | — | WO | disclosed |
| EP-3544964-A1 | HIGH RELAXIVITY GADOLINIUM CHELATE COMPOUNDS FOR USE IN MAGNETIC RESONANCE IMAGING | Bayer Pharma Aktiengesellschaft (DE) | 2019-10-02 | — | — | EP | disclosed |
| WO-2018096082-A1 | HIGH RELAXIVITY GADOLINIUM CHELATE COMPOUNDS FOR USE IN MAGNETIC RESONANCE IMAGING | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-31 | — | — | WO | disclosed |
| CN-102484057-A | Semiconductor surface treatment agent composition and method for treating semiconductor surface using the same | WAKO PURE CHEM IND LTD | 2012-05-30 | — | — | CN | disclosed |
| CN-102483591-A | Resist remover composition and method for removing resist using the composition | WAKO PURE CHEM IND LTD | 2012-05-30 | — | — | CN | disclosed |