SCHEMBL9433739

SCHEMBL9433739

CS(=O)(=O)Nc1ccc(S(=O)(=O)NCCN2CCc3ccccc3C2)cc1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 9/20 0.74
TP53 P04637 1/20 0.59
OPRK1 P41145 1/20 0.53
PRMT5 O14744 2/20 0.52
WDR77 Q9BQA1 2/20 0.52
HTR6 P50406 2/20 0.50
KDM4E B2RXH2 1/20 0.48
CYP2C9 P11712 1/20 0.48

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
SCHEMBL9433748 0.81 HTR7 (0.76) HTR7TP53OPRK1HTR6KDM4E
SCHEMBL8979883 0.81 HTR7 (0.82) HTR7TP53OPRK1HTR6
SCHEMBL9434806 0.80 PRMT5 (0.71) TP53OPRK1PRMT5WDR77KDM4E
Hydrochloric Acid SCHEMBL4230243 0.80 HTR7 (0.80) HTR7TP53OPRK1HTR6
SCHEMBL10035544 0.79 HTR7 (0.82) HTR7TP53OPRK1HTR6
SCHEMBL5741137 0.78 HTR7 (1.00) HTR7HTR6KDM4E
Hydrochloric Acid SCHEMBL2135298 0.78 HTR7 (0.80) HTR7TP53OPRK1HTR6
SCHEMBL8979897 0.78 HTR7 (0.82) HTR7TP53OPRK1HTR6
Hydrochloric Acid SCHEMBL4226132 0.77 HTR7 (0.80) HTR7TP53OPRK1HTR6
SCHEMBL8980040 0.77 HTR7 (0.80) HTR7OPRK1HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5294621-A Thieno tetrahydropyridines useful as class III antiarrhythmic agents ORTHO PHARMACEUTICAL CORPORATION (US) 1994-03-15 US disclosed