SCHEMBL8843296

SCHEMBL8843296

CCCC(=O)ON(Cc1ccccc1)S(=O)(=O)c1cccc(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 6/20 0.58
PGR P06401 2/20 0.54
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51
CHRM5 P08912 1/20 0.47
CYP11B1 P15538 1/20 0.46
MTNR1B P49286 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 2/20 0.43
LIMK2 P53671 1/20 0.43

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
SCHEMBL8843481 0.82 MMP3 (0.48) TAS2R14KEAP1NFE2L2MTNR1BMAPT
SCHEMBL8843594 0.77 TAS2R14 (0.73) TAS2R14PGRKEAP1NFE2L2CYP11B1
SCHEMBL13570528 0.75 MMP9 (0.55) KEAP1NFE2L2
SCHEMBL1279440 0.73 TAS2R14 (1.00) TAS2R14PGR
SCHEMBL6773310 0.71 BMP1 (0.56) TAS2R14PGRKEAP1NFE2L2LMNA
SCHEMBL20503326 0.69 NPC1 (0.47) SMN1; SMN2LMNA
SCHEMBL6121647 0.69 TAS2R14 (0.79) TAS2R14PGR
SCHEMBL8235218 0.69 MMP2 (0.64) TAS2R14PGR
SCHEMBL1615513 0.68 TAS2R14 (1.00) TAS2R14
SCHEMBL29853546 0.68 PGR (0.68) TAS2R14PGRKEAP1NFE2L2CYP11B1

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
US-5672615-A MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS NOVARTIS CORPORATION (US) 1997-09-30 US disclosed