SCHEMBL2188283

SCHEMBL2188283

CS(=O)(=O)c1ccc(O[C@H]2c3cc(Cl)cc(Cl)c3C[C@@H]2N2CCCC2)cc1

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A3 P48764 20/20 0.87
CYP2D6 P10635 2/20 0.75

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
SCHEMBL2186573 0.93 SLC9A3 (1.00) SLC9A3CYP2D6
SCHEMBL2189853 0.93 SLC9A3 (1.00) SLC9A3CYP2D6
SCHEMBL2187463 0.93 SLC9A3 (1.00) SLC9A3CYP2D6
SCHEMBL2187900 0.93 SLC9A3 (1.00) SLC9A3CYP2D6
SCHEMBL2187898 0.93 SLC9A3 (1.00) SLC9A3CYP2D6
SCHEMBL12363170 0.92 SLC9A3 (0.84) SLC9A3CYP2D6
SCHEMBL2190612 0.92 SLC9A3 (0.84) SLC9A3CYP2D6
SCHEMBL3236850 0.91 SLC9A3 (1.00) SLC9A3CYP2D6
SCHEMBL2189041 0.91 SLC9A3 (1.00) SLC9A3CYP2D6
SCHEMBL2188911 0.91 SLC9A3 (1.00) SLC9A3CYP2D6

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-2342178-A1 SUBSTITUTED AMINOINDANES AND ANALOGS THEREOF, AND THE PHARMACEUTICAL USE THEREOF Sanofi-Aventis (FR) 2011-07-13 EP claimed
WO-2010025856-A1 SUBSTITUTED AMINOINDANES AND ANALOGS THEREOF, AND THE PHARMACEUTICAL USE THEREOF SANOFI-AVENTIS (FR) 2010-03-11 WO claimed