SCHEMBL8643575

SCHEMBL8643575

CC1CCCN(CCC(C)NS(=O)(=O)c2cccc3ccccc23)C1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 13/20 0.70
▸ SLC6A9 P48067 5/20 0.63
▸ HRH3 Q9Y5N1 2/20 0.49
▸ HTR1A P08908 1/20 0.47
▸ DRD2 P14416 1/20 0.47
▸ HTR1D P28221 1/20 0.47
▸ HTR1B P28222 1/20 0.47
▸ HTR2A P28223 1/20 0.47
▸ HTR2C P28335 1/20 0.47
▸ ADRA1B P35368 1/20 0.47
▸ DRD3 P35462 1/20 0.47
▸ HTR2B P41595 1/20 0.47

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
SCHEMBL8648348 0.82 SLC6A9 (0.67) HTR7SLC6A9HRH3
SCHEMBL8553908 0.81 HTR7 (1.00) HTR7SLC6A9HRH3HTR1ADRD2
Hydrochloric Acid SCHEMBL8593597 0.80 HTR7 (0.98) HTR7SLC6A9HRH3HTR1ADRD2
SCHEMBL14382102 0.78 SLC6A9 (1.00) HTR7SLC6A9
SCHEMBL10812304 0.78 SLC6A9 (0.60) HTR7SLC6A9
SCHEMBL14382140 0.78 SLC6A9 (1.00) HTR7SLC6A9
SCHEMBL4456849 0.73 HTR7 (0.50) HTR7DRD2HTR1DHTR2AHTR2C
SCHEMBL3945353 0.72 HTR7 (0.49) HTR7HTR1ADRD2HTR1DHTR1B
SCHEMBL20025843 0.71 SLC1A3 (0.55) SLC6A9
SCHEMBL12132457 0.71 KDM4E (0.56) SLC6A9

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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