SCHEMBL28868427

SCHEMBL28868427

COc1ccc(CC(C)O)cc1S(N)(=O)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 6/20 0.54
ADRA1A P35348 6/20 0.54
ADRA1B P35368 6/20 0.54
ADRB2 P07550 1/20 0.54
ADRB1 P08588 1/20 0.54
HTR1A P08908 1/20 0.54
ADRA2A P08913 1/20 0.54
DRD2 P14416 1/20 0.54
ADRA2B P18089 1/20 0.54
ADRA2C P18825 1/20 0.54
HTR2A P28223 1/20 0.54
HTR7 P34969 1/20 0.54
OPRM1 P35372 1/20 0.54
DRD3 P35462 1/20 0.54
HTR2B P41595 1/20 0.54
KCNH2 Q12809 1/20 0.54
PKM P14618 2/20 0.52
GABRA1 P14867 1/20 0.50
GABRB2 P47870 1/20 0.50
ALOX15 P16050 2/20 0.49

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
SCHEMBL28868425 1.00 ADRA1D (0.54) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL30022583 1.00 ADRA1D (0.54) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL14368066 0.88 ADRA1D (0.56) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL29519545 0.87 ADRA1D (0.55) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL3948856 0.87 ADRA1D (0.55) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL1412240 0.87 ADRA1D (0.55) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL1412238 0.87 ADRA1D (0.55) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL13880696 0.87 ADRA1D (0.55) ADRA1DADRA1AADRA1BADRB2ADRB1
SCHEMBL13985850 0.85 ADRA1D (0.54) ADRA1DADRA1AADRA1BADRB2ADRB1
Hydrochloric Acid SCHEMBL6684814 0.85 ADRA1D (0.54) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115232034-B Synthesis method of tamsulosin hydrochloride 上药康丽(常州)药业有限公司 2024-02-20 CN claimed
CN-115232034-A Method for synthesizing tamsulosin hydrochloride 上药康丽(常州)药业有限公司 2022-10-25 CN claimed
CN-115232034-B Synthesis method of tamsulosin hydrochloride 上药康丽(常州)药业有限公司 2024-02-20 CN disclosed
CN-115232034-B Synthesis method of tamsulosin hydrochloride 上药康丽(常州)药业有限公司 2024-02-20 CN disclosed
CN-115232034-A Method for synthesizing tamsulosin hydrochloride 上药康丽(常州)药业有限公司 2022-10-25 CN disclosed
CN-115232034-A Method for synthesizing tamsulosin hydrochloride 上药康丽(常州)药业有限公司 2022-10-25 CN disclosed