SCHEMBL5227430

SCHEMBL5227430

O=S(=O)(c1ccccc1Br)n1cc(C(O)CCN2CCCC2)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 0.53
L3MBTL1 Q9Y468 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL5232161 0.99 HTR6 (0.53) HTR6L3MBTL1CYP3A4CYP2D6
SCHEMBL5231031 0.89 HTR6 (0.57) HTR6CYP3A4CYP2D6
SCHEMBL5226476 0.87 HTR6 (0.51) HTR6L3MBTL1CYP3A4CYP2D6
SCHEMBL5228765 0.86 HTR6 (0.51) HTR6L3MBTL1CYP3A4CYP2D6
SCHEMBL3596183 0.79 HTR6 (0.69) HTR6CYP3A4CYP2D6
SCHEMBL3591828 0.78 HTR6 (0.67) HTR6CYP3A4CYP2D6
SCHEMBL5227156 0.76 HTR6 (0.48) HTR6CYP3A4CYP2D6
SCHEMBL28245177 0.75 HTR6 (0.64) HTR6
SCHEMBL27636794 0.73 HTR6 (0.65) HTR6CYP3A4CYP2D6
SCHEMBL5262967 0.72 HTR6 (0.49) HTR6

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
EP-1523486-B1 TETRACYCLIC ARYLSULFONYL INDOLES HAVING SEROTONIN RECEPTOR AFFINITY SUVEN LIFE SCIENCES LTD (IN) 2007-11-07 EP disclosed