⚠ 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 | |
|---|---|---|---|---|
| Diethylamine SCHEMBL27851538 | 0.85 | TP53 (0.31) | — | |
| Hydrochlorthiazide SCHEMBL15656550 | 0.84 | — | — | |
| Hydrochlorthiazide SCHEMBL25276489 | 0.84 | — | — | |
| Hydrochlorthiazide SCHEMBL19858943 | 0.83 | — | — | |
| Pyrazine SCHEMBL902693 | 0.83 | — | — | |
| Hydrochlorthiazide SCHEMBL450348 | 0.83 | — | — | |
| Hydrochlorthiazide SCHEMBL3110285 | 0.83 | — | — | |
| Hydrochlorthiazide SCHEMBL6291 | 0.83 | — | — | |
| Hydrochlorthiazide SCHEMBL9336266 | 0.83 | — | — | |
| Hydrochlorthiazide SCHEMBL28300130 | 0.82 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110519989-A | Fungicidal compositions and their use | JIANGSU ROTAM CHEMISTRY CO LTD | 2019-11-29 | — | — | CN | claimed |
| CN-115087639-A | Substituted 5, 6-diphenyl-3 (2H) -pyridazinones for use as fungicides | FMC公司 | 2022-09-20 | — | — | CN | disclosed |
| CN-114945558-A | Fungicidal amides | FMC公司 | 2022-08-26 | — | — | CN | disclosed |
| CN-108715590-B | Thiazolecarboxamide and picolinamide compounds useful as PIM kinase inhibitors | 因赛特公司 | 2022-03-08 | — | — | CN | disclosed |
| CN-108440444-B | 2-methyl-4-trifluoromethyl-5-thiazole formamide compound | 江苏再拓生物科技有限公司 | 2021-01-19 | — | — | CN | disclosed |
| CN-112079769-A | Carboxamide compounds for the treatment of metabolic disorders | 里格尔药品股份有限公司 | 2020-12-15 | — | — | CN | disclosed |
| CN-106928211-B | Carboxamide compounds for the treatment of metabolic disorders | 里格尔药品股份有限公司 | 2020-09-08 | — | — | CN | disclosed |
| CN-111233787-A | Green pesticide composition and preparation method thereof | 湖南博隽生物医药有限公司 | 2020-06-05 | — | — | CN | disclosed |
| CN-111226949-A | Environment-friendly plant bactericide | 湖南博隽生物医药有限公司 | 2020-06-05 | — | — | CN | disclosed |
| CN-107674073-A | 3,5 2 as protein kinase modulators substitute 3H imidazoles (or [1,2,3] triazole) simultaneously [4,5 B] pyridine compounds | 印蔻真治疗公司 | 2018-02-09 | — | — | CN | disclosed |
| CN-103068824-B | Novel 3, 5-disubstituted-3H-imidazo [4,5-B ] pyridines and 3, 5-disubstituted-3H- [1,2,3] triazolo [4,5-B ] pyridine compounds as protein kinase modulators | 印蔻真治疗公司 | 2017-09-08 | — | — | CN | disclosed |
| CN-107082779-A | It is used as the noval chemical compound of C MET protein kinase modulators | 理森制药股份公司 | 2017-08-22 | — | — | CN | disclosed |
| EP-1658288-B1 | 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2007-12-05 | — | — | EP | disclosed |