SCHEMBL7215648

SCHEMBL7215648

Cc1cccc(S(=O)(=O)N(C)CCN2CCNCC2)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.49
HTR7 P34969 3/20 0.49
HTR1D P28221 2/20 0.49
DRD3 P35462 2/20 0.49
HTR2C P28335 2/20 0.49
HTR2A P28223 2/20 0.49
SIGMAR1 Q99720 3/20 0.47
CCR5 P51681 1/20 0.43
ADRB1 P08588 1/20 0.40
NMT1 P30419 1/20 0.39
HTR1A P08908 2/20 0.39
HTR1B P28222 1/20 0.39
SRC P12931 1/20 0.39
HTR6 P50406 3/20 0.38
CHRM3 P20309 1/20 0.38

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
SCHEMBL7217320 0.82 ALDH1A1 (0.53) DRD2HTR7HTR1DDRD3HTR2C
SCHEMBL17277488 0.77 HTR2A (0.49) DRD2HTR7HTR1DDRD3HTR2C
SCHEMBL17277400 0.76 HTR2A (0.48) DRD2HTR7HTR1DDRD3HTR2C
SCHEMBL7215377 0.76 KCNH2 (0.43) DRD2HTR7HTR1DDRD3HTR2C
SCHEMBL29991400 0.76 KMT2A (0.62) DRD2HTR7HTR2AHTR1ASRC
SCHEMBL7221715 0.75 KMT2A (0.50) DRD2HTR7HTR1DDRD3CCR5
SCHEMBL5431476 0.74 SIGMAR1 (0.59) DRD2DRD3SIGMAR1SRC
SCHEMBL29172712 0.74 KMT2A (0.59) DRD2HTR7HTR2AHTR1AHTR6
SCHEMBL29991080 0.74 KMT2A (0.59) DRD2HTR7HTR2AHTR1AHTR6
SCHEMBL14045823 0.74 GAA (0.43) HTR6CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6660751-B1 Sulfonamide derivatives as 5-HT7 receptor antagonists SMITHKLINE BEECHAM P.L.C. (GB) 2003-12-09 US disclosed
EP-1163221-A1 SULFONAMIDE DERIVATIVES AS 5HT7 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2001-12-19 EP disclosed
WO-2000056712-A1 SULFONAMIDE DERIVATIVES AS 5-HT7 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2000-09-28 WO disclosed