SCHEMBL3984332

SCHEMBL3984332

CCCCN1CCN(c2nc3c(S(=O)(=O)c4cccc5ccccc45)cccc3o2)CC1.CCCN1CCN(c2nc3c(S(=O)(=O)c4cccc5ccccc45)cccc3o2)CC1

nearest known ligand 0.96

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 0.96

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
SCHEMBL3909607 0.98 HTR6 (1.00) HTR6
SCHEMBL3906567 0.96 HTR6 (1.00) HTR6
SCHEMBL3920558 0.88 HTR6 (1.00) HTR6
Hydrochloric Acid SCHEMBL4075286 0.87 HTR6 (0.98) HTR6
SCHEMBL3982350 0.85 HTR6 (1.00) HTR6
Hydrochloric Acid SCHEMBL4087854 0.84 HTR6 (0.98) HTR6
SCHEMBL4078875 0.82 HTR6 (0.82) HTR6
SCHEMBL4262888 0.82 HTR6 (0.76) HTR6
Hydrochloric Acid SCHEMBL4255403 0.81 HTR6 (0.75) HTR6
SCHEMBL3916565 0.80 HTR6 (1.00) 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-2024348-A2 BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES AS 5-HYDROXYTRYTAMINE-6 LIGANDS Wyeth (US) 2009-02-18 EP claimed
WO-2007142904-A2 BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES AS 5-HYDROXYTRYTAMINE-6 LIGANDS WYETH (US) 2007-12-13 WO claimed