SCHEMBL29285446

SCHEMBL29285446

Cc1ccc(S(=O)(=O)OCCC2CCCN2C(=O)OC(C)(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
APP P05067 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
DRD2 P14416 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
SLC6A2 P23975 1/20 0.44
HRH2 P25021 1/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR7 P34969 1/20 0.44
DRD3 P35462 1/20 0.44
OPRK1 P41145 1/20 0.44
HTR2B P41595 1/20 0.44

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
SCHEMBL8702996 0.98 LMNA (0.44) LMNANPSR1MEN1KMT2AAPP
SCHEMBL16538611 0.95 GPR119 (0.45) LMNANPSR1MEN1KMT2AAPP
SCHEMBL16538625 0.95 GPR119 (0.45) LMNANPSR1MEN1KMT2AAPP
SCHEMBL7414912 0.94 GPR119 (0.43) LMNANPSR1MEN1KMT2AAPP
SCHEMBL7414916 0.94 GPR119 (0.43) LMNANPSR1MEN1KMT2AAPP
SCHEMBL143674 0.91 LMNA (0.47) LMNANPSR1MEN1KMT2AAPP
SCHEMBL345625 0.91 LMNA (0.47) LMNANPSR1MEN1KMT2AAPP
SCHEMBL86666 0.91 LMNA (0.47) LMNANPSR1MEN1KMT2AAPP
SCHEMBL4093277 0.88 NPSR1 (0.44) LMNANPSR1MEN1KMT2AAPP
SCHEMBL25319775 0.88 GPR119 (0.47) LMNANPSR1MEN1KMT2AGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324715-A Compounds, compositions, and methods of use thereof 艾勒维生技公司 2024-07-12 CN disclosed
CN-117750962-A Compounds, compositions, and methods of use thereof 艾勒维生技公司 2024-03-22 CN disclosed