SCHEMBL4015652

SCHEMBL4015652

COc1ccc(C[C@@H](C)NCCc2ccccc2)cc1S(=O)(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 6/20 0.58
ADRA1A P35348 6/20 0.58
ADRA1B P35368 6/20 0.58
ADRB2 P07550 1/20 0.55
ADRB1 P08588 1/20 0.55
HTR1A P08908 1/20 0.55
ADRA2A P08913 1/20 0.55
DRD2 P14416 1/20 0.55
ADRA2B P18089 1/20 0.55
ADRA2C P18825 1/20 0.55
HTR2A P28223 1/20 0.55
HTR7 P34969 1/20 0.55
OPRM1 P35372 1/20 0.55
DRD3 P35462 1/20 0.55
HTR2B P41595 1/20 0.55
KCNH2 Q12809 1/20 0.55
SIGMAR1 Q99720 10/20 0.54
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
SLC2A1 P11166 1/20 0.47

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
SCHEMBL6135926 0.89 ADRA1D (0.73) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL6135925 0.89 ADRA1D (0.73) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL8867439 0.83 SIGMAR1 (0.70) KCNH2SIGMAR1SLC2A1
SCHEMBL2424851 0.82 ADRA1D (0.81) ADRA1DADRA1AADRA1BADRB2ADRB1
Hydrochloric Acid SCHEMBL8868043 0.82 SIGMAR1 (0.72) KCNH2SIGMAR1SLC2A1
Hydrochloric Acid SCHEMBL2423704 0.81 ADRA1D (0.80) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL2429677 0.81 SIGMAR1 (0.51) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL2423873 0.81 SIGMAR1 (0.51) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL2423875 0.81 SIGMAR1 (0.51) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL6094958 0.78 SIGMAR1 (0.65) ADRB2KCNH2SIGMAR1ALDH1A1SLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1828110-B8 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF HOVIONE INT LTD (CH) 2009-07-01 EP claimed
EP-1828110-A1 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF Hovione Inter Ltd. (CH) 2007-09-05 EP claimed
WO-2006061549-A1 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF HOVIONE INTER LTD. (CH) 2006-06-15 WO claimed
EP-1828110-B8 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF HOVIONE INT LTD (CH) 2009-07-01 EP disclosed
EP-1828110-A1 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF Hovione Inter Ltd. (CH) 2007-09-05 EP disclosed
WO-2006061549-A1 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF HOVIONE INTER LTD. (CH) 2006-06-15 WO disclosed