⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL27726514 | 0.97 | HDAC1 (0.44) | — | |
| Hydrochloric Acid SCHEMBL27656812 | 0.97 | HDAC1 (0.44) | — | |
| SCHEMBL17784486 | 0.97 | HDAC1 (0.44) | — | |
| SCHEMBL30337581 | 0.79 | — | — | |
| SCHEMBL13470 | 0.79 | — | — | |
| SCHEMBL5347385 | 0.77 | ACHE (0.40) | — | |
| SCHEMBL6246291 | 0.77 | ALDH1A1 (0.44) | — | |
| SCHEMBL26750806 | 0.75 | CYP2A6 (0.46) | — | |
| SCHEMBL8146926 | 0.75 | CYP2A6 (0.46) | — | |
| SCHEMBL29388695 | 0.75 | — | — |
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 883 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12582634-B2 | Synthetic methods for preparation of 4-(2-chloro-4-methoxy-5-methylphenyl)-n-[(1S)-2-cyclopropyl-1-(3-fluoro-4-methylphenyl)ethyl]-5-methyl-n-prop-2-ynyl-1,3-thiazol-2-amine | NEUROCRINE BIOSCIENCES, INC. (US) | 2026-03-24 | — | — | US | claimed |
| CN-120004697-A | Preparation method of OrgVO material and application of OrgVO material as secondary battery anode material | 同济大学 | 2025-05-16 | — | — | CN | claimed |
| US-20230286932-A1 | SYNTHETIC METHODS FOR PREPARATION OF 4-(2-CHLORO-4-METHOXY-5-METHYLPHENYL)-N-[(1S)-2-CYCLOPROPYL-1-(3-FLUORO-4-METHYLPHENYL)ETHYL]-5-METHYL-N-PROP-2-YNYL-1,3-THIAZOL-2-AMINE | NEUROCRINE BIOSCIENCES, INC. | 2023-09-14 | — | — | US | claimed |
| CN-115087647-A | Synthetic method for preparing 4- (2-chloro-4-methoxy-5-methylphenyl) -N- [ (1S) -2-cyclopropyl-1- (3-fluoro-4-methylphenyl) ethyl ] -5-methyl-N-prop-2-alkynyl-1, 3-thiazol-2-amine | 纽罗克里生物科学有限公司 | 2022-09-20 | — | — | CN | claimed |
| WO-2021111179-A1 | SYNTHETIC METHOD FOR PREPARATION OF 4-(2-CHLORO-4-METHOXY-5-METHYLPHENYL)-N-[(1S)-2-CYCLOPROPYL-1-(3-FLUORO-4-METHYLPHENYL)ETHYL]-5-METHYL-N-PROP-2-YNYL-1,3-THIAZOL-2-AMINE | NEUROCRINE BIOSCIENCES, INC. (US) | 2021-06-10 | — | — | WO | claimed |
| CN-110724047-B | Method for preparing aromatic carboxylic acid compound | 中国科学院大连化学物理研究所 | 2020-10-30 | — | — | CN | claimed |
| CN-110724047-A | Method for preparing aromatic carboxylic acid compound | 中国科学院大连化学物理研究所 | 2020-01-24 | — | — | CN | claimed |
| EP-1539753-B1 | PYRAZOLO(3,4-B)PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS | GLAXO GROUP LTD (GB) | 2009-09-09 | — | — | EP | claimed |
| US-20080175914-A1 | Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors | GLAXO GROUP LIMITED | 2008-07-24 | — | — | US | claimed |
| CN-100387598-C | Pyrazolo[3,4-b]pyridine compounds, and their use as phosphodiesterase inhibitors | GLAXO GROUP LTD (GB) | 2008-05-14 | — | — | CN | claimed |
| WO-2004024728-A2 | PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2004-03-25 | — | — | WO | claimed |
| WO-2003055833-A1 | PROCESS FOR THERMAL BENZYLIC BROMINATION | ALBEMARLE CORPORATION (US) | 2003-07-10 | — | — | WO | claimed |
| US-20030105350-A1 | Process for thermal benzylic bromination | MORTENSEN MAX K (US) | 2003-06-05 | — | — | US | claimed |
| EP-1057801-A2 | Process for benzylic bromination | ALBEMARLE CORPORATION (US) | 2000-12-06 | — | — | EP | claimed |
| CN-1047377-C | Preparation method of 2-fluor-4-bromotoluene, 2-fluor-4-bromo benzyl bromide and its 2-fluor-4-bromo benzyl bromide | FUXIN SPECIAL CHEMICALS CO LTD (CN) | 1999-12-15 | — | — | CN | claimed |
| CN-1157812-A | Preparation method of 2-fluor-4-bromotoluene, 2-fluor-4-bromo benzyl bromide and its 2-fluor-4-bromo benzyl bromide | FUXIN SPECIAL CHEMICALS CO LTD (CN) | 1997-08-27 | — | — | CN | claimed |
| EP-0519600-B1 | Process and intermediate for making isoquinoline derivatives | AMERICAN HOME PROD (US) | 1997-06-11 | — | — | EP | claimed |
| EP-0519600-A1 | Process and intermediate for making isoquinoline derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-12-23 | — | — | EP | claimed |
| US-4786640-A | TREATMENT OR PREVENTION OF DIABETIC COMPLICATIONS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1988-11-22 | — | — | US | claimed |
| US-4786638-A | TREATMENT OR PREVENTION OF DIABETIC COMPLICATIONS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1988-11-22 | — | — | US | claimed |