SCHEMBL3376828

SCHEMBL3376828

NCC(c1ccccc1)S(N)(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.50
HTR2A P28223 3/20 0.50
GABBR2 O75899 2/20 0.42
GABBR1 Q9UBS5 2/20 0.42
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
HRH1 P35367 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA9 Q16790 3/20 0.40
CA5A P35218 2/20 0.40
CA12 O43570 2/20 0.40

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
SCHEMBL4226373 0.83 CA2 (0.45) TAAR1HTR2AHRH1CYP2C19CA1
Hydrochloric Acid SCHEMBL320519 0.82 HRH1 (0.52) TAAR1HTR2AGABBR2GABBR1HRH1
SCHEMBL4554083 0.81 TAAR1 (0.48) TAAR1HTR2AGABBR2GABBR1CHRNB2
SCHEMBL30600579 0.81 CYP2C19 (0.41) TAAR1HTR2AGABBR2GABBR1CYP2D6
SCHEMBL988364 0.81 LMNA (0.43) TAAR1HTR2ACYP2C19CA1CA2
SCHEMBL9184436 0.81 TAAR1 (0.48) TAAR1HTR2AGABBR2GABBR1CHRNB2
SCHEMBL1663424 0.81 SRC (0.53) TAAR1HTR2AGABBR2GABBR1CHRNB2
Hydrochloric Acid SCHEMBL31111546 0.79 LMNA (0.42) TAAR1HTR2ACA1CA2CA9
SCHEMBL3808204 0.79 EPHX1 (0.47) TAAR1SLC6A4SLC6A3CYP1A2CA1
SCHEMBL3472313 0.78 AOC3 (0.43) TAAR1HRH1CA1CA2CA9

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-1996544-B1 A METHOD OF PREPARATION OF (R)-(-)-5(2-AMINOPROPYL)-2-METHOXYBENZENESULFONAMIDE ZENTIVA KS (CZ) 2010-11-10 EP disclosed
US-7638649-B2 Method of preparation of (R)-(−)-5-(2-aminopropyl)-2-methoxybenzenesulfonamide ZENTIVA, K.S. (CZ) 2009-12-29 US disclosed
US-20080319225-A1 Method of Preparation of (R)-(-)-5(2-Aminopropyl)-2-Methoxybenzenesulfonamide ZENTIVA, A.S. (CZ) 2008-12-25 US disclosed
EP-1996544-A1 A METHOD OF PREPARATION OF (R)-(-)-5(2-AMINOPROPYL)-2-METHOXYBENZENESULFONAMIDE Zentiva, a.s. (CZ) 2008-12-03 EP disclosed
WO-2005075415-A1 A METHOD OF PREPARATION OF (R)-(-)-5(2-AMINOPROPYL)-2-METHOXYBENZENESULFONAMIDE ZENTIVA, A.S. (CZ) 2005-08-18 WO disclosed
WO-2003035608-A1 A METHOD OF THE PREPARATION OF (R)-(-)-5`2-`2-(2-ETHOXYPHENOXY) ETHYLAMINO! PROPYL!-2-METHOXYBENZENESULPHONAMIDE (TAMSULOSIN) LECIVA, A.S. (CZ) 2003-05-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080319225-A1 Method of Preparation of (R)-(-)-5(2-Aminopropyl)-2-Methoxybenzenesulfonamide NPSR1, TPSAB1, TPSB2 TAAR1 98/4885HTR2A 354/4885GABBR2 1362/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.