SCHEMBL2183133

SCHEMBL2183133

O=S1(=O)NCN(C2CC2)c2ccc(Oc3cccc(Br)c3)cc21

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 17/20 0.79
GRIA1 P42261 2/20 0.56
GRIA3 P42263 2/20 0.56
GRIA4 P48058 2/20 0.56

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
SCHEMBL2152856 0.90 GRIA2 (0.80) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2179977 0.88 GRIA2 (1.00) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2153213 0.86 GRIA2 (1.00) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2152720 0.86 GRIA2 (1.00) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2183722 0.84 GRIA2 (1.00) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2775552 0.83 GRIA2 (0.70) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2152080 0.82 GRIA2 (1.00) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2152051 0.82 GRIA2 (1.00) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2183666 0.80 GRIA2 (0.70) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2161138 0.80 GRIA2 (0.82) GRIA2GRIA1GRIA3GRIA4

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
WO-2011083265-A1 NOVEL DERIVATIVES OF CYCLOPROPYLATED BENZOTHIADIAZINES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2011-07-14 WO claimed
WO-2011083265-A1 NOVEL DERIVATIVES OF CYCLOPROPYLATED BENZOTHIADIAZINES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2011-07-14 WO disclosed