SCHEMBL28284166

SCHEMBL28284166

NC(=S)NN=C1CCNc2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSL P07711 13/20 0.67
MEN1 O00255 2/20 0.49
GAA P10253 2/20 0.49
KMT2A Q03164 2/20 0.49
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL28381906 0.81 CTSL (0.73) CTSLKDM4EALDH1A1L3MBTL1NPSR1
SCHEMBL28887932 0.81 CTSL (0.73) CTSLKDM4EALDH1A1L3MBTL1NPSR1
SCHEMBL6337478 0.81 CTSL (1.00) CTSLKDM4EALDH1A1L3MBTL1NPSR1
SCHEMBL18477265 0.79 CTSL (0.53) CTSLMEN1GAAKMT2AKDM4E
SCHEMBL28381876 0.78 CTSL (0.52) CTSLMEN1GAAKMT2AKDM4E
SCHEMBL28384974 0.78 CTSL (0.52) CTSLMEN1GAAKMT2ASMN1; SMN2
SCHEMBL28383150 0.78 CTSL (0.52) CTSLMEN1GAAKMT2AKDM4E
SCHEMBL28383046 0.78 CTSL (0.58) CTSLMEN1GAAKMT2AKDM4E
SCHEMBL28388654 0.78 CTSL (0.58) CTSLGAAKMT2ASMN1; SMN2KDM4E
SCHEMBL28387201 0.77 CTSL (0.64) CTSLKDM4EALDH1A1L3MBTL1NPSR1

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-109503478-A 2,3- dihydro -1H- quinolin-4-one thiosemicarbazone derivative and its preparation method and application 岭南师范学院 2019-03-22 CN claimed
CN-109503478-B 2, 3-dihydro-1H-quinoline-4-ketone thiosemicarbazone derivative and preparation method and application thereof 岭南师范学院 2020-04-24 CN disclosed
CN-109503478-A 2,3- dihydro -1H- quinolin-4-one thiosemicarbazone derivative and its preparation method and application 岭南师范学院 2019-03-22 CN disclosed
CN-109503478-A 2,3- dihydro -1H- quinolin-4-one thiosemicarbazone derivative and its preparation method and application 岭南师范学院 2019-03-22 CN disclosed
CN-109503478-A 2,3- dihydro -1H- quinolin-4-one thiosemicarbazone derivative and its preparation method and application 岭南师范学院 2019-03-22 CN disclosed