SCHEMBL8027974

SCHEMBL8027974

Cc1ccc(S(=O)(=O)c2nnn3c2nc(N(C)C)c2sccc23)cc1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.69
RXFP1 Q9HBX9 5/20 0.68
MAPT P10636 6/20 0.63
TP53 P04637 1/20 0.61

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
SCHEMBL8028235 0.85 HTR6 (0.89) HTR6RXFP1MAPT
SCHEMBL15287801 0.85 HTR6 (0.64) HTR6RXFP1MAPT
SCHEMBL8030932 0.83 RXFP1 (0.79) HTR6RXFP1MAPTTP53
SCHEMBL4355492 0.81 RXFP1 (1.00) HTR6RXFP1MAPT
SCHEMBL8016803 0.79 HTR6 (0.83) HTR6RXFP1MAPTTP53
SCHEMBL8029076 0.79 HTR6 (1.00) HTR6RXFP1MAPTTP53
SCHEMBL15287867 0.77 HTR6 (1.00) HTR6RXFP1MAPT
SCHEMBL16507160 0.77 HTR6 (0.63) HTR6RXFP1MAPTTP53
SCHEMBL15287900 0.77 HTR6 (0.57) HTR6RXFP1MAPT
SCHEMBL8032618 0.77 HTR6 (0.88) HTR6RXFP1MAPTTP53

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
WO-2009093934-A2 SUBSTITUTED 3-SULPHONYL-[1,2,3]TRIAZOLO [1,5-A]PYRIMIDINES-ANTAGONISTS OF SEROTONIN 5-HT6 RECEPTORS, MEDICINAL SUBSTANCE, PHARMACEUTICAL COMPOSITION, MEDICINAL PREPARATION AND METHODS FOR THE PRODUCTION THEREOF ALLA CHEM, LLC (US) 2009-07-30 WO disclosed