SCHEMBL5331620

SCHEMBL5331620

CC1CCCc2cc(S(=O)(=O)c3cccc(F)c3)ccc21

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.68

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
SCHEMBL14346787 1.00 HTR6 (0.68) HTR6
SCHEMBL10263415 0.88 HTR6 (0.66) HTR6
SCHEMBL21869968 0.88 HTR6 (0.66) HTR6
SCHEMBL5331614 0.84 HTR6 (0.68) HTR6
SCHEMBL315347 0.81 HTR6 (1.00) HTR6
SCHEMBL315247 0.81 HTR6 (1.00) HTR6
SCHEMBL316484 0.81 HTR6 (0.81) HTR6
SCHEMBL12428612 0.81 HTR6 (0.81) HTR6
Hydrochloric Acid SCHEMBL316371 0.80 HTR6 (0.98) HTR6
SCHEMBL2856362 0.80 HTR6 (0.69) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831159-A1 TETRALIN AND INDANE DERIVATIVES AND USES THEREOF F. Hoffmann-Roche AG (CH) 2007-09-12 EP disclosed
WO-2006066790-A1 TETRALIN AND INDANE DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2006-06-29 WO disclosed