⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL179926 | 0.80 | — | — | |
| SCHEMBL8097987 | 0.78 | — | — | |
| SCHEMBL73033 | 0.69 | — | — | |
| SCHEMBL2068301 | 0.69 | — | — | |
| SCHEMBL4651146 | 0.67 | — | — | |
| SCHEMBL5911561 | 0.66 | — | — | |
| SCHEMBL10864000 | 0.65 | — | — | |
| SCHEMBL5911016 | 0.65 | — | — | |
| SCHEMBL3986271 | 0.63 | — | — | |
| SCHEMBL3975745 | 0.60 | — | — |
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 198 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024145585-A1 | COMPOUNDS AND METHODS FOR TREATING CANCER | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2024-07-04 | — | — | WO | claimed |
| CN-111484482-B | Alkynyl pyrimidine or alkynyl pyridine compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2022-06-21 | — | — | CN | claimed |
| EP-3666767-B1 | PHTHALAZINONE DERIVATIVES, METHOD FOR THEIR PREPARATION THEREOF, PHARMACEUTICAL COMPOSITION COMPRISING THEM, AND THEIR USE | SHANGHAI INST MATERIA MEDICA CAS (CN) | 2021-12-01 | — | — | EP | claimed |
| US-11040952-B2 | Phthalazinone compound, method for preparation thereof, pharmaceutical composition thereof, and use thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2021-06-22 | — | — | US | claimed |
| CN-109134429-B | Phthalazinone compound, preparation method, pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2021-06-01 | — | — | CN | claimed |
| CN-112341378-A | Urea substituted alkynyl pyrimidine or urea substituted alkynyl pyridine compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2021-02-09 | — | — | CN | claimed |
| CN-111484482-A | Alkynyl pyrimidine or alkynyl pyridine compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2020-08-04 | — | — | CN | claimed |
| EP-3666767-A1 | PYRIDAZINONE COMPOUND, METHOD FOR PREPARATION THEREOF, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2020-06-17 | — | — | EP | claimed |
| US-20200181109-A1 | PHTHALAZINONE COMPOUND, METHOD FOR PREPARATION THEREOF, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2020-06-11 | — | — | US | claimed |
| US-9856216-B2 | Compounds as TNIK, IKKε and TBK1 inhibitors and pharmaceutical composition comprising same | GREEN CROSS CORPORATION (KR) | 2018-01-02 | — | — | US | claimed |
| EP-0425571-B2 | NOVEL MAGNETIC RESONANCE IMAGING AGENTS | MALLINCKRODT MEDICAL INC (US) | 2000-09-20 | — | — | EP | claimed |
| US-5635607-A | BLUE OR VIOLET COLOR DYE FOR DYEING PAPER, TEXTILES | CIBA-GEIGY CORPORATION (US) | 1997-06-03 | — | — | US | claimed |
| EP-0425571-B1 | NOVEL MAGNETIC RESONANCE IMAGING AGENTS | MALLINCKRODT INC (US) | 1996-09-11 | — | — | EP | claimed |
| EP-0679691-A2 | Cationic or basic aminobenzthiazole dyestuffs | CIBA-GEIGY AG (CH) | 1995-11-02 | — | — | EP | claimed |
| US-5137711-A | PARAMAGNETIC DTPA AND EDTA ALKOXYALKYLAMIDE COMPLEXES AS MRI AGENTS | MALLICKRODT MEDICAL, INC. (US) | 1992-08-11 | — | — | US | claimed |
| US-5130120-A | Diethylenetriaminepentaacetic acid or ethylenediamine tetraacetic acid for magnetic resonance imaging | MALLINCKRODT MEDICAL, INC. (US) | 1992-07-14 | — | — | US | claimed |
| EP-0425571-A1 | NOVEL MAGNETIC RESONANCE IMAGING AGENTS. | MALLINCKRODT INC (US) | 1991-05-08 | — | — | EP | claimed |
| WO-1990001024-A1 | NOVEL MAGNETIC RESONANCE IMAGING AGENTS | MALLINCKRODT, INC. (US) | 1990-02-08 | — | — | WO | claimed |
| US-4017477-A | 3-Halogeno-6-hydroxy-pyridone-(2) azo dyestuffs | CIBA-GEIGY AG (CH) | 1977-04-12 | — | — | US | claimed |
| US-3940395-A | CNS DEPRESSANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1976-02-24 | — | — | US | claimed |