⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3547471 | 0.91 | — | — | |
| SCHEMBL3554376 | 0.88 | — | — | |
| SCHEMBL6420876 | 0.80 | — | — | |
| SCHEMBL200157 | 0.73 | — | — | |
| SCHEMBL10724793 | 0.73 | CES1 (0.47) | — | |
| Pentane SCHEMBL11410718 | 0.71 | — | — | |
| Hexane SCHEMBL11409372 | 0.71 | — | — | |
| SCHEMBL6156290 | 0.71 | — | — | |
| SCHEMBL387657 | 0.71 | — | — | |
| SCHEMBL7875960 | 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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112513011-B | Benzene derivatives | 小野药品工业株式会社 | 2023-06-16 | — | — | CN | disclosed |
| US-20220089532-A1 | BENZENE DERIVATIVE | ONO PHARMACEUTICAL CO., LTD. (JP) | 2022-03-24 | — | — | US | disclosed |
| US-11261154-B2 | Benzene derivative | ONO PHARMACEUTICAL CO., LTD. (JP) | 2022-03-01 | — | — | US | disclosed |
| US-20210332009-A1 | BENZENE DERIVATIVE | ONO PHARMACEUTICAL CO., LTD. (JP) | 2021-10-28 | — | — | US | disclosed |
| EP-3831810-A1 | BENZENE DERIVATIVE | ONO Pharmaceutical Co., Ltd. (JP) | 2021-06-09 | — | — | EP | disclosed |
| US-20210163408-A1 | METHOD FOR PREPARING A POLYFLUORINATED COMPOUND | ETH ZURICH (CH) | 2021-06-03 | — | — | US | disclosed |
| CN-112689623-A | Process for preparing polyfluoro compounds | 瑞士苏黎世联邦理工学院 | 2021-04-20 | — | — | CN | disclosed |
| EP-3802488-A1 | METHOD FOR PREPARING A POLYFLUORINATED COMPOUND | ETH Zurich (CH) | 2021-04-14 | — | — | EP | disclosed |
| CN-112513011-A | Benzene derivatives | 小野药品工业株式会社 | 2021-03-16 | — | — | CN | disclosed |
| WO-2020027150-A1 | BENZENE DERIVATIVE | 小野薬品工業株式会社 | 2020-02-06 | — | — | WO | disclosed |
| WO-2019229103-A1 | METHOD FOR PREPARING A POLYFLUORINATED COMPOUND | ETH ZURICH (CH) | 2019-12-05 | — | — | WO | disclosed |
| CN-1613914-A | Recording layer dye for high speed recordable optical disk | XIANGDE SCIENCE & TECHNOLOGY C (CN) | 2005-05-11 | — | — | CN | disclosed |
| CN-1614700-A | Recording layer dye for high speed recordable optical disk | XIANGDE SCIENCE & TECHNOLOGY C (CN) | 2005-05-11 | — | — | CN | disclosed |
| US-20050066453-A1 | Photochromic dye | NEW PRISMATIC ENTERPRISE CO., LTD. (TW) | 2005-03-31 | — | — | US | disclosed |
| EP-0540854-B1 | Preparation for promoting hair growth | SANSHO SEIYAKU KK (JP) | 1998-01-21 | — | — | EP | disclosed |
| US-5656264-A | ADMINISTERING TO THE SCALP OF THE MALE A PREPERATION CONSITING OF 6-BENZYLAMINOPURINE | SANSYO SEIYAKU CO., LTD. (JP) | 1997-08-12 | — | — | US | disclosed |
| EP-0540854-A2 | Preparation for promoting hair growth | Sansho Seiyaku Co., Ltd. (JP) | 1993-05-12 | — | — | EP | disclosed |