SCHEMBL5320224

SCHEMBL5320224

CCOc1ccccc1OCC(=O)NCCCc1ccc(OC)c(S(N)(=O)=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA1D P25100 2/20 0.56
▸ ADRA1A P35348 2/20 0.56
▸ ADRA1B P35368 2/20 0.56
▸ ADRB2 P07550 1/20 0.56
▸ ADRB1 P08588 1/20 0.56
▸ HTR1A P08908 1/20 0.56
▸ ADRA2A P08913 1/20 0.56
▸ DRD2 P14416 1/20 0.56
▸ ADRA2B P18089 1/20 0.56
▸ ADRA2C P18825 1/20 0.56
▸ HTR2A P28223 1/20 0.56
▸ HTR7 P34969 1/20 0.56
▸ OPRM1 P35372 1/20 0.56
▸ DRD3 P35462 1/20 0.56
▸ HTR2B P41595 1/20 0.56
▸ KCNH2 Q12809 1/20 0.56
▸ MTNR1A P48039 2/20 0.53
▸ MTNR1B P49286 2/20 0.53
▸ HSD17B10 Q99714 1/20 0.51
▸ MAPT P10636 2/20 0.50

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
SCHEMBL4777691 0.80 ADRA1D (0.69) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL4777698 0.80 ADRA1D (0.69) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL5322077 0.79 ADRA1A (0.52) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL14301033 0.79 ADRA1A (0.70) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL14533980 0.77 ADRA1D (0.58) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL4362747 0.76 ADRA1D (0.56) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL9633827 0.76 MTNR1A (0.49) ADRA1DADRA1AADRA1BMTNR1AMTNR1B
SCHEMBL13575906 0.75 ADRA1A (0.65) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL29873391 0.73 ADRA1A (0.94) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL6039195 0.73 CA2 (0.53) ADRA1DADRA1AADRA1BADRB2ADRB1

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
WO-2007086074-A2 A PROCESS FOR THE PREPARATION OF R (-) TAMSULOSIN HYDROCHLORIDE USV LIMITED (IN) 2007-08-02 — — WO disclosed
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