SCHEMBL29161027

SCHEMBL29161027

NC(=O)c1c2ccccc2nn1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.56
AURKA O14965 1/20 0.56
CSNK1A1 P48729 1/20 0.56
CDK8 P49336 1/20 0.56
NEK2 P51955 1/20 0.56
LIMK1 P53667 1/20 0.56
CDK5 Q00535 1/20 0.56
DYRK1A Q13627 1/20 0.56
CLK4 Q9HAZ1 1/20 0.56
MPO P05164 1/20 0.49
PARP1 P09874 1/20 0.48
KMT2A Q03164 2/20 0.44
GRM2 Q14416 2/20 0.44
ESR2 Q92731 1/20 0.44
RIPK2 O43353 1/20 0.44
SCN9A Q15858 1/20 0.43
RCE1 Q9Y256 1/20 0.42
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41

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
SCHEMBL6411455 0.86 CHEK1 (0.68) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL30828481 0.85 CCNA2 (0.44) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL9910900 0.82 CHEK1 (0.59) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL6416275 0.80 MEN1 (0.58) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL29794663 0.76 MPO (0.45) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL23320433 0.76 MPO (0.49) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL30636856 0.76 RIPK1 (0.51) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL2723759 0.76 LCK (0.41) GRM2KDM4EHPGDLMNASRC
SCHEMBL23854775 0.75 PARP1 (0.52) DYRK1APARP1
SCHEMBL31457212 0.74 CHEK1 (0.53) CHEK1AURKACSNK1A1CDK8NEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115385858-B Photocatalytic preparation method of 2-phenyl-2H-indazole-3-carboxamide compound 河南师范大学 2024-03-01 CN claimed
CN-115385858-B Photocatalytic preparation method of 2-phenyl-2H-indazole-3-carboxamide compound 河南师范大学 2024-03-01 CN disclosed
CN-115385858-B Photocatalytic preparation method of 2-phenyl-2H-indazole-3-carboxamide compound 河南师范大学 2024-03-01 CN disclosed
CN-115385858-B Photocatalytic preparation method of 2-phenyl-2H-indazole-3-carboxamide compound 河南师范大学 2024-03-01 CN disclosed
CN-115385858-A Photocatalytic preparation method of 2-phenyl-2H-indazole-3-formamide compound 河南师范大学 2022-11-25 CN disclosed