SCHEMBL25708294

SCHEMBL25708294

CC1(C)OCc2cc(C(O)CNCc3ccccc3)ccc2O1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 3/20 0.47
SLC16A3 O15427 1/20 0.42
LMNA P02545 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ADRB2 P07550 5/20 0.40
ADRA1D P25100 1/20 0.40
PLA2G1B P04054 1/20 0.39
POLB P06746 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39

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
SCHEMBL4801268 1.00 ADRB3 (0.47) ADRB3SLC16A3LMNAMEN1KMT2A
Tetrabuthylammonium SCHEMBL6746933 0.90 ADRB3 (0.40) ADRB3SLC16A3LMNAMEN1KMT2A
SCHEMBL5431193 0.82 ADRB2 (0.45) ADRB3LMNAADRB2ADRA1D
SCHEMBL17660490 0.82 KMT2A (0.39) ADRB3MEN1KMT2AADRB2ADRA1D
SCHEMBL5391885 0.82 ADRB3 (0.45) ADRB3ADRB2ADRA1D
SCHEMBL5436285 0.82 ADRB2 (0.42) ADRB3LMNAADRB2ADRA1D
SCHEMBL14357339 0.81 ADRB2 (0.57) ADRB3LMNAMEN1KMT2AADRB2
SCHEMBL14357338 0.81 ADRB2 (0.57) ADRB3LMNAMEN1KMT2AADRB2
SCHEMBL5423178 0.81 ADRB2 (0.43) ADRB3LMNAADRB2
SCHEMBL2829651 0.81 ADRB2 (0.57) ADRB3LMNAMEN1KMT2AADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023097697-A1 METHOD FOR SYNTHESIZING (1R)-1-(2,2-DIMETHYL-4H-1,3-BENZODIOXIN-6-YL)OXAZOLIDIN-2-ONE 广东莱佛士制药技术有限公司 2023-06-08 WO disclosed
CN-1266126-C Phenylethanolamine derivatives for the treatment of respiratory diseases GLAXO GROUP LTD (GB) 2006-07-26 CN disclosed
CN-1501911-A Phenethanolamine derivatives for treatment of respiratory diseases 2004-06-02 CN disclosed