SCHEMBL28057136

SCHEMBL28057136

CS(=O)(=O)c1cnc2ccccc2c1O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.51
PABPC1 P11940 1/20 0.43
EIF4H Q15056 1/20 0.43
GRM5 P41594 6/20 0.41
KDM4E B2RXH2 1/20 0.40
GPR3 P46089 1/20 0.40
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NR1H2 P55055 1/20 0.37

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
SCHEMBL30200365 0.83 ERN1 (0.51) ERN1GRM5KDM4EGPR3TP53
SCHEMBL19692977 0.83 ERN1 (0.51) ERN1GRM5KDM4EGPR3TP53
SCHEMBL15307431 0.80 GRM5 (0.58) ERN1GRM5KDM4EGAAPKM
SCHEMBL1346789 0.79 GRM5 (0.63) GRM5KDM4EGAATP53MAPT
SCHEMBL528975 0.78 SLC22A12 (0.47) GAASMN1; SMN2
SCHEMBL28782754 0.77 GRM5 (0.53) GRM5L3MBTL1MAPTSMN1; SMN2NR1H2
SCHEMBL29712688 0.77 GRM5 (0.53) GRM5L3MBTL1MAPTSMN1; SMN2NR1H2
SCHEMBL15355043 0.76 ERN1 (0.46) ERN1GRM5KDM4EGPR3GAA
SCHEMBL11064349 0.76 ERN1 (0.44) ERN1GRM5KDM4EGPR3GAA
SCHEMBL9796489 0.76 ERN1 (0.44) ERN1GRM5KDM4EGPR3GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103153063-B Quinoline derivatives and melk inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2016-02-17 CN disclosed