SCHEMBL5203578

SCHEMBL5203578

Cc1ccc(Cc2cnc[nH]2)cc1NS(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 2/20 0.53
ADRA2A P08913 1/20 0.53
HRH3 Q9Y5N1 8/20 0.44
MAPT P10636 3/20 0.43
HRH4 Q9H3N8 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
ADRA2C P18825 1/20 0.43
CYP3A4 P08684 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL21636133 0.77 HRH3 (0.57) HRH3MAPTHRH4TAAR1CYP3A4
SCHEMBL5206471 0.75 ADRA2A (0.54) ADRA1AADRA2AHRH3MAPTHRH4
SCHEMBL5201429 0.74 ADRA1A (0.48) ADRA1AADRA2AHRH3MAPTHRH4
SCHEMBL5204050 0.74 ADRA1A (0.42) ADRA1AADRA2AHRH3MAPTHRH4
SCHEMBL7099288 0.74 MAPT (0.43) ADRA1AADRA2AMAPTADRA2CSMN1; SMN2
SCHEMBL12299574 0.73 MAPT (0.67) ADRA1AADRA2AMAPTADRA2CSMN1; SMN2
SCHEMBL5200888 0.71 RAD52 (0.49) ADRA1AADRA2ATAAR1ADRA2C
SCHEMBL27551589 0.71 HRH3 (0.53) HRH3MAPTHRH4TAAR1CYP3A4
Hydrochloric Acid SCHEMBL5201249 0.70 RAD52 (0.48) ADRA1AADRA2AMAPTTAAR1ADRA2C
Oxalic Acid SCHEMBL5200567 0.70 ADRA1A (0.38) ADRA1AADRA2AHRH3MAPTHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0887346-B1 N-Phenyl-alkylsulfonamide derivatives, their preparation and their use as alpha1A/1L adrenoceptor agonists HOFFMANN LA ROCHE (CH) 2007-12-12 EP disclosed
US-6057349-A ALPHA.SUB.1A/1L AGONISTS USED IN THE TREATMENT OF VARIOUS DISEASE STATES SUCH AS URINARY INCONTINENCE, NASAL CONGESTION, PRIAPISM, DEPRESSION, ANXIETY, DEMENTIA, SENILITY, ALZHEIMER'S, DEFICIENCIES IN ATTENTIVENESS AND COGNITION, AND F. HOFFMAN LA ROCHE AG (CH) 2000-05-02 US disclosed
US-5973038-A Thermoplastic polymer compositions containing black dye compositions EASTMAN CHEMICAL COMPANY (US) 1999-10-26 US disclosed
US-5952362-A INHIBITOR OF GLYCOGEN PHOSPHORYLASE ENZYMETIC ACTIVITY AND GLUCOSE ACITIVITY SYNTEX (U.S.A) INC. (US) 1999-09-14 US disclosed
EP-0887346-A2 Phenyl-and aminophenyl-alkylsulfonamide and urea derivatives, their preparation and their use as alpha1A/1L adrenoceptor agonists F. HOFFMANN-LA ROCHE AG (CH) 1998-12-30 EP disclosed