SCHEMBL28464487

SCHEMBL28464487

N#Cc1nc(I)cnc1O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.30
ALB P02768 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL15257937 0.75 JAK3 (0.33)
SCHEMBL23508934 0.75 HTT (0.33) TTRALB
SCHEMBL15257962 0.75 ALDH1A1 (0.36)
SCHEMBL1336348 0.75 ALOX5AP (0.31)
SCHEMBL12466516 0.75 ALDH1A1 (0.36)
SCHEMBL12466671 0.75 CSNK1A1 (0.37)
SCHEMBL28648721 0.75 HTT (0.33)
SCHEMBL28691950 0.68 GABRG2 (0.35)
SCHEMBL28469042 0.67
SCHEMBL25275854 0.67

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113106130-B Application of nitrile hydratase derived from staphylococcus aggregatus in preparation of amide pyrazine compounds 核芯生物医药科技(杭州)有限公司 2023-03-14 CN claimed
CN-113106130-A Application of nitrile hydratase derived from staphylococcus aggregatus in preparation of amide pyrazine compounds 浙江恒康药业股份有限公司 2021-07-13 CN claimed
CN-113025671-A Application of nitrile hydratase derived from sinorhizobium meliloti in preparation of amide pyrazine compounds 浙江恒康药业股份有限公司 2021-06-25 CN claimed
CN-111662938-A Application of nitrile hydratase in catalyzing hydration reaction of cyanopyrazine compound to generate amide pyrazine compound 浙江恒康药业股份有限公司 2020-09-15 CN claimed
CN-113106130-B Application of nitrile hydratase derived from staphylococcus aggregatus in preparation of amide pyrazine compounds 核芯生物医药科技(杭州)有限公司 2023-03-14 CN disclosed
CN-113025671-B Application of nitrile hydratase derived from sinorhizobium meliloti in preparation of amide pyrazine compounds 浙江恒康药业股份有限公司 2023-01-31 CN disclosed
CN-113106130-A Application of nitrile hydratase derived from staphylococcus aggregatus in preparation of amide pyrazine compounds 浙江恒康药业股份有限公司 2021-07-13 CN disclosed
CN-113025671-A Application of nitrile hydratase derived from sinorhizobium meliloti in preparation of amide pyrazine compounds 浙江恒康药业股份有限公司 2021-06-25 CN disclosed
CN-111662938-B Application of nitrile hydratase in catalyzing hydration reaction of cyanopyrazine compound to generate amide pyrazine compound 浙江恒康药业股份有限公司 2021-05-04 CN disclosed
CN-111662938-A Application of nitrile hydratase in catalyzing hydration reaction of cyanopyrazine compound to generate amide pyrazine compound 浙江恒康药业股份有限公司 2020-09-15 CN disclosed