SCHEMBL29135070

SCHEMBL29135070

O=C(Nc1nccs1)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.68
HTT P42858 4/20 0.68
ALDH1A1 P00352 4/20 0.68
KDM4E B2RXH2 2/20 0.68
MAPT P10636 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
HPGD P15428 1/20 0.68
NPC1 O15118 1/20 0.68
GAA P10253 2/20 0.67
TSHR P16473 1/20 0.67
NPSR1 Q6W5P4 1/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
AKR1C3 P42330 1/20 0.63
NR3C1 P04150 1/20 0.62
AR P10275 1/20 0.62
CASP3 P42574 1/20 0.62
SENP8 Q96LD8 1/20 0.62
SENP7 Q9BQF6 1/20 0.62
SENP6 Q9GZR1 1/20 0.62
MEN1 O00255 2/20 0.62

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
SCHEMBL30679109 1.00 LMNA (0.68) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL29135066 0.90 MEN1 (0.68) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL30679111 0.90 MEN1 (0.68) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL29977722 0.84 L3MBTL1 (0.67) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL663488 0.84 L3MBTL1 (0.67) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL30679106 0.81 L3MBTL1 (0.67) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL29135077 0.81 L3MBTL1 (0.67) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL29978632 0.80 L3MBTL1 (0.69) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL666048 0.80 L3MBTL1 (0.69) LMNAHTTALDH1A1KDM4EMAPT
SCHEMBL29134722 0.80 AKR1C3 (0.64) LMNAHTTALDH1A1KDM4EMAPT

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-117298108-A Androgen receptor and glucocorticoid receptor dual-target inhibitor and application thereof 浙江师范大学 2023-12-29 CN disclosed