SCHEMBL6580188

SCHEMBL6580188

Cc1c(C[CH]C(C)(C)C)c2cc(S(=O)(=O)c3cc(F)cc(F)c3)ccc2n1C

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 13/20 0.45
PARG Q86W56 3/20 0.37
PTGDR2 Q9Y5Y4 4/20 0.34
PTGDR Q13258 1/20 0.33

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
SCHEMBL6577807 0.87 HTR6 (0.39) HTR6PARGPTGDR2
SCHEMBL6579484 0.86 HTR6 (0.47) HTR6PARGPTGDR2
SCHEMBL6577381 0.86 HTR6 (0.48) HTR6PARG
SCHEMBL6580232 0.81 HTR6 (0.48) HTR6PTGDR2
SCHEMBL6575514 0.81 HTR6 (0.45) HTR6PTGDR2PTGDR
Hydrochloric Acid SCHEMBL6577886 0.80 HTR6 (0.44) HTR6PTGDR2PTGDR
SCHEMBL6577305 0.79 HTR6 (0.44) HTR6PARGPTGDR2PTGDR
Hydrochloric Acid SCHEMBL6577805 0.78 HTR6 (0.43) HTR6PARGPTGDR2PTGDR
SCHEMBL6577278 0.75 SPR (0.45) HTR6PARG
SCHEMBL7170076 0.74 HTR6 (0.39) HTR6PTGDR2PTGDR

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-1411925-A1 5-ARYLSULFONYL INDOLES HAVING 5-HT6 RECEPTOR AFFINITY PHARMACIA & UPJOHN COMPANY (US) 2004-04-28 EP disclosed
WO-2003011284-A1 5-ARYLSULFONYL INDOLES HAVING 5-HT6 RECEPTOR AFFINITY PHARMACIA & UPJOHN COMPANY (US) 2003-02-13 WO disclosed