SCHEMBL7658239

SCHEMBL7658239

Cc1nc(=O)n(-c2ccccc2)[nH]1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
HSD17B10 Q99714 1/20 0.62
LMNA P02545 3/20 0.51
KDM4E B2RXH2 3/20 0.51
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
TP53 P04637 1/20 0.46
LOX P28300 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LOXL2 Q9Y4K0 1/20 0.46
GAA P10253 6/20 0.46
ALOX15 P16050 1/20 0.46
HTT P42858 2/20 0.45
L3MBTL1 Q9Y468 3/20 0.43
MAPT P10636 3/20 0.43
RXFP1 Q9HBX9 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
TSHR P16473 1/20 0.43
MPI P34949 1/20 0.43
HPGD P15428 1/20 0.42

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
SCHEMBL28146047 0.77 KDM4E (0.47) ALDH1A1HSD17B10LMNAKDM4ENPC1
SCHEMBL7652511 0.76 KDM4E (0.51) ALDH1A1HSD17B10LMNAKDM4ENPC1
SCHEMBL7656287 0.76 TP53 (0.49) ALDH1A1HSD17B10LMNAKDM4ENPC1
SCHEMBL7650665 0.76 KDM4E (0.64) ALDH1A1LMNAKDM4ENPC1RAB9A
SCHEMBL11177031 0.75 ALDH1A1 (0.47) ALDH1A1HSD17B10LMNAKDM4ENPC1
SCHEMBL29143074 0.75 NOX4 (0.45) ALDH1A1HSD17B10MAPTHPGDMEN1
SCHEMBL28364722 0.75 ALDH1A1 (0.55) ALDH1A1HSD17B10KDM4EMAPTSMN1; SMN2
SCHEMBL14446895 0.73 KDM4E (0.66) ALDH1A1HSD17B10LMNAKDM4ENPC1
SCHEMBL7652940 0.73 KDM4E (0.51) ALDH1A1LMNAKDM4ENPC1RAB9A
SCHEMBL17629066 0.72 TSHR (0.45) ALDH1A1HSD17B10LMNAKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115819358-B Method for continuously synthesizing 3-methyl-1-phenyl-1, 2, 4-triazole-5-ketone metal salt 湖南化工研究院有限公司 2025-02-11 CN claimed
CN-115819358-A Method for continuously synthesizing 3-methyl-1-phenyl-1, 2, 4-triazole-5-ketone metal salt 湖南化工研究院有限公司 2023-03-21 CN claimed
CN-112225705-A Preparation method of 3-methyl-1-phenyl-1H-1,2, 4-triazole-5 (4H) -ketone 湖南海利常德农药化工有限公司 2021-01-15 CN claimed
CN-115819358-B Method for continuously synthesizing 3-methyl-1-phenyl-1, 2, 4-triazole-5-ketone metal salt 湖南化工研究院有限公司 2025-02-11 CN disclosed
CN-114044758-B Synthetic method of intermediate for preparing triazolinone herbicide sulfenamide 浙大宁波理工学院 2024-03-26 CN disclosed
CN-115819358-A Method for continuously synthesizing 3-methyl-1-phenyl-1, 2, 4-triazole-5-ketone metal salt 湖南化工研究院有限公司 2023-03-21 CN disclosed
CN-112225705-B Preparation method of 3-methyl-1-phenyl-1H-1,2, 4-triazole-5 (4H) -ketone 湖南海利常德农药化工有限公司 2022-06-07 CN disclosed
CN-109232450-B Synthetic method of sulfentrazone 山东润博生物科技有限公司 2022-01-25 CN disclosed
CN-112225705-A Preparation method of 3-methyl-1-phenyl-1H-1,2, 4-triazole-5 (4H) -ketone 湖南海利常德农药化工有限公司 2021-01-15 CN disclosed
CN-111689915-A Preparation method of 1- (2, 4-dichlorophenyl) -4-difluoromethyl-3-methyl-1H-1, 2, 4-triazole-5-ketone 湖南斯派克科技股份有限公司 2020-09-22 CN disclosed
US-6492407-B2 NEUROPROTECTIVE ACTIVITY BOEHRINGER IMGELHEIM PHARMA KG (DE) 2002-12-10 US disclosed