SCHEMBL7836637

SCHEMBL7836637

CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc3[nH]ccc23)cc1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.68
HTR6 P50406 1/20 0.65
HTT P42858 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
BDKRB1 P46663 8/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GFER P55789 1/20 0.51
LMNA P02545 2/20 0.51
ALDH1A1 P00352 1/20 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
SCHEMBL5746400 0.80 HTR6 (0.76) HTR6SMN1; SMN2TDP1MEN1KMT2A
SCHEMBL12259110 0.80 KMT2A (0.77) GAAHTTSMN1; SMN2TDP1BDKRB1
SCHEMBL7837239 0.79 HTR6 (1.00) GAAHTR6HTTSMN1; SMN2TDP1
SCHEMBL13046884 0.78 MAPK1 (0.61) HTR6MEN1KMT2AALDH1A1
SCHEMBL8414789 0.77 HTR6 (0.71) GAAHTR6MEN1KMT2ALMNA
SCHEMBL14478903 0.74 EP300 (0.71) GAAHTTSMN1; SMN2BDKRB1MEN1
SCHEMBL6351422 0.74 HTT (0.67) GAAHTTSMN1; SMN2BDKRB1MEN1
SCHEMBL19853016 0.74 TDP1 (0.65) GAAHTTSMN1; SMN2TDP1BDKRB1
SCHEMBL12259256 0.73 ALDH1A1 (0.69) GAAHTTSMN1; SMN2TDP1BDKRB1
SCHEMBL31668702 0.73 TRPV1 (0.65)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0815861-B1 Sulphonamides and their use HOFFMANN LA ROCHE (CH) 2001-09-19 EP disclosed
US-6030976-A SELECTIVE AFFINITY TO 5HT-6 RECEPTORS; CENTRAL NERVOUS SYSTEM DISORDERS; ALZHEIMER'S DISEASE, PSYCHOSES, SCHIZOPHRENIA, MANIC DEPRESSIONS, MEMORY DISORDERS, PARKINSON'S DISEASE, AMYOTROPHIC LATERAL SCLEROSIS AND HUNTINGTON'S DISEASE HOFFMAN-LA ROCHE INC. (US) 2000-02-29 US disclosed
US-5998665-A THERAPY FOR NERVOUS SYSTEM DISORDERS HOFFMANN-LA ROCHE INC. (US) 1999-12-07 US disclosed
EP-0815861-A1 Sulphonamides and their use F. HOFFMANN-LA ROCHE AG (CH) 1998-01-07 EP disclosed