SCHEMBL5310965

SCHEMBL5310965

O=[C]CC1CCCc2cc(S(=O)(=O)c3ccccc3)ccc21

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.73
KDM4C Q9H3R0 2/20 0.53

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
SCHEMBL316539 0.85 HTR6 (1.00) HTR6
SCHEMBL14346717 0.85 HTR6 (0.77) HTR6KDM4C
SCHEMBL315531 0.85 HTR6 (1.00) HTR6
SCHEMBL5623744 0.84 HTR6 (0.83) HTR6
SCHEMBL1706402 0.84 HTR6 (0.75) HTR6KDM4C
SCHEMBL316499 0.84 HTR6 (0.83) HTR6
SCHEMBL315712 0.82 HTR6 (0.73) HTR6KDM4C
Hydrochloric Acid SCHEMBL314662 0.82 HTR6 (0.81) HTR6
SCHEMBL1698035 0.82 HTR6 (0.73) HTR6KDM4C
SCHEMBL10263435 0.82 HTR6 (0.73) HTR6KDM4C

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