SCHEMBL3791607

SCHEMBL3791607

CC(C(N)=O)S(=O)(=O)OC1CCNCC1c1ccc(-c2ccccc2Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 1/20 0.39
SLC6A2 P23975 9/20 0.37
SLC6A4 P31645 9/20 0.37
SLC6A3 Q01959 6/20 0.36
KCNH2 Q12809 4/20 0.36
CYP2D6 P10635 3/20 0.36
HTR1A P08908 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
HTR2A P28223 1/20 0.35
HTR1E P28566 1/20 0.35
HTR7 P34969 1/20 0.35
HTR2B P41595 1/20 0.35
HTR3A P46098 1/20 0.35
HTR5A P47898 1/20 0.35
HTR6 P50406 1/20 0.35
LRRK2 Q5S007 1/20 0.35
MBTPS1 Q14703 1/20 0.35
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL3794324 0.73 GRIA4 (0.49) KCNH2
SCHEMBL3204364 0.73 GRIA4 (0.49) KCNH2
SCHEMBL3264851 0.69 TACR1 (0.39) SLC6A2SLC6A4
SCHEMBL3192427 0.68 GRIA4 (0.47) SLC6A2SLC6A4KCNH2
SCHEMBL3192449 0.68 GRIA4 (0.47) SLC6A2SLC6A4KCNH2
SCHEMBL3192440 0.68 GRIA4 (0.47) SLC6A2SLC6A4KCNH2
SCHEMBL28775715 0.62 SCN9A (0.48) LRRK2AKR1C3
Hydrochloric Acid SCHEMBL998149 0.62 LMNA (0.32) CYP3A4
SCHEMBL3205035 0.61 GRIA2 (0.52) KCNH2
SCHEMBL28051546 0.60 JAK3 (0.49) HTR1AHTR1DHTR1BHTR2AHTR1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142505-A1 SULFONAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF Pfizer, Inc. (US) 2010-01-13 EP disclosed
WO-2008120093-A1 SULFONAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER INC. (US) 2008-10-09 WO disclosed