SCHEMBL9682981

SCHEMBL9682981

COC(=O)c1nc(Br)c[nH]c1=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.45
ERCC1 P07992 2/20 0.39
FEN1 P39748 2/20 0.39
ERCC4 Q92889 2/20 0.39
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 2/20 0.37
RNASEH1 O60930 1/20 0.37
NR4A2 P43354 1/20 0.36
CHEK1 O14757 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
STAT3 P40763 1/20 0.35
HIF1A Q16665 1/20 0.35
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 1/20 0.33

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
SCHEMBL6375917 0.79 NPSR1 (0.45) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL6382584 0.79 NPSR1 (0.45) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL31478620 0.77 F2 (0.40) NPSR1KDM4EALDH1A1NR4A2GAA
SCHEMBL6380750 0.76 NPSR1 (0.41) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL17429945 0.72 MAPK1 (0.39) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL388845 0.69 NPSR1 (0.50) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL30570809 0.69 NPSR1 (0.56) NPSR1KDM4EALDH1A1KDM4CSTAT3
SCHEMBL5747714 0.69 NPSR1 (0.50) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL29829085 0.69 NPSR1 (0.50) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL27989922 0.69 SLC22A6 (0.36) ERCC1ERCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102603657-B Preparation method of 6-bromine-3-hydroxyl-2-pyrazinamide SHANDONG QIDU PHARMACEUTICAL 2015-02-04 CN claimed
US-12528778-B2 Microbiocidal derivatives SYNGENTA CROP PROTECTION AG (CH) 2026-01-20 US disclosed
US-12371428-B2 Pyridone compounds and methods of use EXELIXIS, INC. (US) 2025-07-29 US disclosed
CN-113924294-B Microbiocidal derivatives 先正达农作物保护股份公司 2024-12-06 CN disclosed
EP-3976601-B1 MICROBIOCIDAL DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-02-28 EP disclosed
US-20230192628-A1 MICROBIOCIDAL DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2023-06-22 US disclosed
US-20220315579-A1 PYRIDONE COMPOUNDS AND METHODS OF USE EXELIXIS, INC. 2022-10-06 US disclosed
EP-4034532-A1 PYRIDONE COMPOUNDS AND METHODS OF USE IN THE MODULATION OF A PROTEIN KINASE Exelixis, Inc. (US) 2022-08-03 EP disclosed
CN-114787144-A Pyridone compounds and methods for modulating protein kinases 埃克塞里艾克西斯公司 2022-07-22 CN disclosed
CN-113924294-A Microbicidal derivatives 先正达农作物保护股份公司 2022-01-11 CN disclosed
WO-2021062245-A1 PYRIDONE COMPOUNDS AND METHODS OF USE IN THE MODULATION OF A PROTEIN KINASE EXELIXIS, INC. (US) 2021-04-01 WO disclosed
WO-2020239853-A1 MICROBIOCIDAL DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2020-12-03 WO disclosed
CN-102603657-B Preparation method of 6-bromine-3-hydroxyl-2-pyrazinamide SHANDONG QIDU PHARMACEUTICAL 2015-02-04 CN disclosed
CN-102603657-A Preparation method of 6-bromine-3-hydroxyl-2-pyrazinamide SHANDONG QIDU PHARMACEUTICAL 2012-07-25 CN disclosed
US-5079251-A Insecticides, pesticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-01-07 US disclosed
EP-0408196-A2 Pyrazinone derivatives as insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-16 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12371428-B2 Pyridone compounds and methods of use PDXK, PLK2, MAP4K2 NPSR1 4208/4885ERCC1 1583/4885FEN1 1136/4885
US-12528778-B2 Microbiocidal derivatives CCR1, CCR6, CCRL2 NPSR1 1873/4885ERCC1 132/4885FEN1 774/4885
US-20230192628-A1 MICROBIOCIDAL DERIVATIVES MPO, PRF1, MSR1 NPSR1 2130/4885ERCC1 1556/4885FEN1 947/4885
US-20220315579-A1 PYRIDONE COMPOUNDS AND METHODS OF USE PDXK, PLK2, MAP4K2 NPSR1 4208/4885ERCC1 1583/4885FEN1 1136/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.