⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL455656 | 1.00 | CYP2A6 (0.61) | — | |
| SCHEMBL8068361 | 1.00 | CYP2A6 (0.61) | — | |
| Fluoride SCHEMBL5504537 | 0.93 | CYP2A6 (0.53) | — | |
| SCHEMBL10356669 | 0.90 | ALDH1A1 (0.55) | — | |
| SCHEMBL74194 | 0.90 | ALDH1A1 (0.55) | — | |
| Iodobenzene SCHEMBL22799141 | 0.87 | ALDH1A1 (0.56) | — | |
| SCHEMBL17818509 | 0.85 | CYP2A6 (0.44) | — | |
| SCHEMBL23800916 | 0.83 | CYP2A6 (0.42) | — | |
| SCHEMBL15641109 | 0.83 | CYP2A6 (0.42) | — | |
| SCHEMBL9338417 | 0.83 | APP (0.52) | — |
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
Appears in 10049 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-122080065-A | Preparation method of all-benzene-ring rigid twisted skeleton self-assembly material (Ph-CbzPPA) and application of material in perovskite solar cell | — | 2026-05-26 | — | — | CN | claimed |
| CN-122059975-A | Eight-membered ring condensed boron dipyrrole compound and preparation method thereof | 中国科学院宁波材料技术与工程研究所 | 2026-05-19 | — | — | CN | claimed |
| CN-121574107-A | Method for synthesizing aryl thiobenzothiazole compound based on cuprous chloride | 苏州大学 | 2026-02-27 | — | — | CN | claimed |
| CN-119775225-B | Preparation method and application of pure organic X-ray scintillator material | 厦门大学 | 2025-06-13 | — | — | CN | claimed |
| CN-119899395-A | Preparation method and application of copper cluster-phenothiazinyl metal organic framework with visible light catalytic C-N bond cross-coupling performance | 大连理工大学 | 2025-04-29 | — | — | CN | claimed |
| WO-2025073270-A1 | BIPHENYL TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 海南因瑞生物医药科技有限公司 | 2025-04-10 | — | — | WO | claimed |
| CN-119775225-A | Preparation method and application of pure organic X-ray scintillator material | 厦门大学 | 2025-04-08 | — | — | CN | claimed |
| CN-119504701-A | Novel fluorescent probe based on triphenylamine and preparation method and application thereof | 广东医科大学 | 2025-02-25 | — | — | CN | claimed |
| WO-2025030778-A1 | STAR-LIKE MICROMOLECULAR CROSS-LINKED HOLE TRANSPORT MATERIAL, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 天津大学 | 2025-02-13 | — | — | WO | claimed |
| CN-119390644-A | Metal organic tetrahedral cage compound and preparation method and application thereof | 大连理工大学 | 2025-02-07 | — | — | CN | claimed |
| US-20030092769-A1 | DIARYL-ENYNES | NPS ALLELIX CORPORATION (CA) | 2003-05-15 | — | — | US | claimed |
| EP-1198434-A4 | PROCESS TO REMOVE POLY(ARYLENE SULFIDE) BASED DEPOSITS FROM AN ARTICLE | PHILLIPS PETROLEUM CO (US) | 2002-10-02 | — | — | EP | claimed |
| EP-1198434-A1 | PROCESS TO REMOVE POLY(ARYLENE SULFIDE) BASED DEPOSITS FROM AN ARTICLE | Phillips Petroleum Company (US) | 2002-04-24 | — | — | EP | claimed |
| WO-2002020697-A2 | POLAR TOLANE LIQUID CRYSTALS | HRL LABORATORIES, LLC (US) | 2002-03-14 | — | — | WO | claimed |
| WO-2000068159-A1 | PROCESS TO REMOVE POLY(ARYLENE SULFIDE) BASED DEPOSITS FROM AN ARTICLE | PHILLIPS PETROLEUM COMPANY (US) | 2000-11-16 | — | — | WO | claimed |
| US-6082380-A | Process to remove poly(arylene sulfide) based deposits from an article | PHILLIPS PETROLEUM COMPANY (US) | 2000-07-04 | — | — | US | claimed |
| WO-2000032644-A1 | PROCESSES FOR THE RECOVERY OF POLY(ARYLENE SULFIDE) | PHILLIPS PETROLEUM COMPANY (US) | 2000-06-08 | — | — | WO | claimed |
| US-5254776-A | Synthesis of bromobiphenyls | MALLINCKRODT SPECIALTY CHEMICALS COMPANY (US) | 1993-10-19 | — | — | US | claimed |
| US-5110901-A | Polythioethers | PHILLIPS PETROLEUM COMPANY (US) | 1992-05-05 | — | — | US | claimed |
| US-3933957-A | Process for producing shaped articles from an acetylenic polymer | GENERAL ELECTRIC COMPANY (US) | 1976-01-20 | — | — | US | claimed |