SCHEMBL1287503

SCHEMBL1287503

COC(=O)c1ccc(S(=O)(=O)N(CCCc2ccccc2)Cc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 17/20 0.71
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
POLB P06746 1/20 0.65
PTGES O14684 2/20 0.65
CXCR3 P49682 2/20 0.65
TAS2R8 Q9NYW2 1/20 0.65

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
SCHEMBL1287263 0.91 POLB (0.69) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1287314 0.91 MEN1 (0.77) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1287407 0.85 TAS2R14 (0.81) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1287273 0.85 MEN1 (0.89) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1287410 0.85 TAS2R14 (0.72) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1278914 0.83 TAS2R14 (1.00) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1615931 0.83 TAS2R14 (1.00) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1287359 0.82 TAS2R14 (0.83) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1287322 0.82 MEN1 (0.65) TAS2R14MEN1KMT2APOLBPTGES
SCHEMBL1287492 0.82 PSEN1 (0.58) TAS2R14MEN1KMT2APOLBCXCR3

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-2012047926-A2 SULFONAMIDE-CONTAINING COMPOUNDS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2012-04-12 WO disclosed