SCHEMBL2178746

SCHEMBL2178746

CS(=O)(=O)Nc1ccc(Oc2ccc3c(c2)S(O)(O)NCN3C2CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 13/20 0.58
PGR P06401 1/20 0.41
MMP13 P45452 1/20 0.39
GRIA1 P42261 2/20 0.38
GRIA3 P42263 2/20 0.38
GRIA4 P48058 2/20 0.38
MMP2 P08253 2/20 0.38
MMP3 P08254 1/20 0.38
MMP9 P14780 1/20 0.38
MMP14 P50281 1/20 0.38
LTA4H P09960 1/20 0.38
MMP1 P03956 1/20 0.38

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
SCHEMBL2178739 0.89 GRIA2 (0.71) GRIA2GRIA1GRIA3GRIA4
SCHEMBL5482709 0.80 LTA4H (0.41) GRIA2PGRMMP13MMP2MMP3
SCHEMBL2182018 0.78 GRIA2 (0.59) GRIA2MMP13GRIA1GRIA3GRIA4
SCHEMBL2161137 0.78 GRIA2 (0.62) GRIA2GRIA1GRIA3GRIA4
SCHEMBL5621041 0.74 GRIA2 (0.40) GRIA2PGR
SCHEMBL2152080 0.74 GRIA2 (1.00) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2183726 0.73 GRIA2 (0.77) GRIA2GRIA1GRIA3GRIA4
SCHEMBL5484644 0.72 GRIA2 (0.40) GRIA2PGR
SCHEMBL2152051 0.71 GRIA2 (1.00) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2179977 0.70 GRIA2 (1.00) 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 1 patent. 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