⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9502832 | 0.89 | — | — | |
| SCHEMBL27801823 | 0.81 | ALDH1A1 (0.38) | — | |
| SCHEMBL318997 | 0.81 | EPHX1 (0.48) | — | |
| Bicarbonate SCHEMBL4051237 | 0.80 | — | — | |
| Bicarbonate SCHEMBL10664497 | 0.79 | EPHX1 (0.41) | — | |
| SCHEMBL2057747 | 0.79 | EPHX1 (0.42) | — | |
| SCHEMBL10723720 | 0.78 | ALDH1A1 (0.37) | — | |
| SCHEMBL318696 | 0.78 | ALDH1A1 (0.37) | — | |
| SCHEMBL134210 | 0.78 | ALDH1A1 (0.37) | — | |
| Acetic Acid SCHEMBL1287799 | 0.77 | — | — |
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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118702683-A | Phenyl ethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, compositions and methods thereof | 凌科药业(杭州)有限公司 | 2024-09-27 | — | — | CN | disclosed |
| CN-113993861-B | Phenyl ethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, compositions and methods thereof | 凌科药业(杭州)有限公司 | 2024-05-14 | — | — | CN | disclosed |
| CN-103764658-B | Compound, its pharmaceutical composition and its purposes as the IDH1 mutant inhibitor for treating cancer | 安吉奥斯医药品有限公司 | 2017-06-09 | — | — | CN | disclosed |
| CN-106715415-A | 3-amino-1, 5,6, 7-tetrahydro-4H-indol-4-ones | 拜耳制药股份公司 | 2017-05-24 | — | — | CN | disclosed |
| EP-2808324-A1 | PYRROLE COMPOUND | Kabushiki Kaisha Yakult Honsha (JP) | 2014-12-03 | — | — | EP | disclosed |
| US-20140343017-A1 | PYRROLE COMPOUND | KABUSHIKI KAISHA YAKULT HONSHA (JP) | 2014-11-20 | — | — | US | disclosed |
| CN-103764658-A | Compounds, their pharmaceutical compositions and their uses as IDH1 mutants inhibitors for treating cancers | AGIOS PHARMACEUTICALS INC | 2014-04-30 | — | — | CN | disclosed |
| CN-101679413-B | New 3-([1,2,4]triazolo[4,3-a]pyridin-7-yl)benzamide derivatives | ALMIRALL LAB | 2013-07-03 | — | — | CN | disclosed |
| CN-101959883-B | 3-indazolyl-4-pyridylisothiazoles | LILLY CO ELI | 2013-01-30 | — | — | CN | disclosed |
| CN-1910156-B | Malononitrile compound as pesticide | SUMITOMO CHEMICAL CO | 2011-08-17 | — | — | CN | disclosed |
| CN-1910156-A | Malononitrile compound as pesticide | SUMITOMO CHEMICAL CO (JP) | 2007-02-07 | — | — | CN | disclosed |
| US-7012143-B2 | Cycloalkyl-[4-(difluorophenyl)-oxazol-5-yl]-triazolo-pyridines | DOMBROSKI MARK A | 2006-03-14 | — | — | US | disclosed |
| US-7005523-B2 | Cycloalkyl-[4-(trifluorophenyl)-oxazol-5yl]-triazolo-pyridines | PFIZER INC. (US) | 2006-02-28 | — | — | US | disclosed |
| EP-1537108-A1 | DI AND TRIFLUORO-TRIAZOLO-PYRIDINES ANTI-INFLAMMATORY COMPOUNDS | Pfizer Products Inc. (US) | 2005-06-08 | — | — | EP | disclosed |
| US-20040157877-A1 | Cycloalkyl-[4-(trifluorophenyl)-oxazol-5yl]-triazolo-pyridines | PFIZER INC | 2004-08-12 | — | — | US | disclosed |
| US-20040087615-A1 | Cycloalkyl-[4-(difluorophenyl)-oxazol-5-yl]-triazolo-pyridines | PFIZER INC | 2004-05-06 | — | — | US | disclosed |
| US-20040053958-A1 | Di and trifluoro-triazolo-pyridines anti-inflammatory compounds | PFIZER INC. | 2004-03-18 | — | — | US | disclosed |
| WO-2004020440-A1 | DI AND TRIFLUORO-TRIAZOLO-PYRIDINES ANTI-INFLAMMATORY COMPOUNDS | PFIZER PRODUCTS INC. (US) | 2004-03-11 | — | — | WO | disclosed |
| CN-1025456-C | Yellow dye-forming coupler and silver halide color photographic material containing same | FUJI PHOTO FILM CO LTD (JP) | 1994-07-13 | — | — | CN | disclosed |
| CN-1057911-A | Form the coupling agent of weld and the color silver halide photographic-material that contains this coupling agent | FUJI PHOTO FILM CO LTD (JP) | 1992-01-15 | — | — | CN | disclosed |