SCHEMBL8556599

SCHEMBL8556599

CN(CCCCN1CCCCC1)S(=O)(=O)c1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 10/20 0.51
▸ HTR2A P28223 5/20 0.51
▸ HTR2C P28335 3/20 0.51
▸ HRH3 Q9Y5N1 4/20 0.48
▸ HTR6 P50406 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.47
▸ SIGMAR1 Q99720 2/20 0.45
▸ SLC6A9 P48067 1/20 0.45
▸ MMP1 P03956 1/20 0.44
▸ MMP2 P08253 1/20 0.44
▸ MMP3 P08254 1/20 0.44
▸ MMP8 P22894 1/20 0.44
▸ MMP13 P45452 1/20 0.44

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
SCHEMBL8592975 0.85 NPSR1 (0.56) HTR7HTR2AHTR2CHTR6
Hydrochloric Acid SCHEMBL8625338 0.84 NPSR1 (0.55) HTR7HTR2AHTR2CHTR6
SCHEMBL20314709 0.78 HTR2A (0.47) HTR2AHTR2CHTR6TDP1
SCHEMBL8552320 0.76 HTR7 (0.70) HTR7HTR2AHTR6SLC6A9
SCHEMBL5125937 0.75 KEAP1 (0.52) HTR2AHTR2CTDP1
SCHEMBL15830503 0.75 SIGMAR1 (0.58) HTR2AHTR2CHRH3TDP1SIGMAR1
SCHEMBL19287839 0.74 SIGMAR1 (0.54) HTR7HTR2AHRH3SIGMAR1
SCHEMBL491691 0.74 SIGMAR1 (0.51) HTR2AHTR2CHRH3MEN1KMT2A
SCHEMBL8557740 0.74 SLC6A9 (0.53) HTR7HTR2AHTR2CHTR6MEN1
SCHEMBL30639804 0.74 NPY5R (0.50) HTR7HTR2AHTR2CHTR6

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-0883613-A1 SULFONAMIDE DERIVATIVES AS 5HT7 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-12-16 — — EP disclosed
WO-1997029097-A1 SULFONAMIDE DERIVATIVES AS 5HT7 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-08-14 — — WO disclosed
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