SCHEMBL7428751

SCHEMBL7428751

Nc1ccc2c(c1)S(=O)(=O)CC2CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 4/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
HIF1A Q16665 1/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
FFAR1 O14842 2/20 0.34
CA9 Q16790 3/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
PPARD Q03181 3/20 0.32
PPARG P37231 2/20 0.32

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
SCHEMBL7431183 0.82 FFAR1 (0.39) FFAR1CA1CA2PPARDPPARG
SCHEMBL7424900 0.79 PPARA (0.45) FFAR1PPARDPPARG
SCHEMBL7430025 0.78 MAPT (0.44) SLC10A2MAPTFFAR1
SCHEMBL7426297 0.78 CYP1A2 (0.40) MAPTHIF1ACA9CA12
SCHEMBL7435758 0.72 TP53 (0.34) FFAR1PPARDPPARG
SCHEMBL29509616 0.71 CA9 (0.46) SLC10A2CA9CA12CA1CA2
SCHEMBL7437211 0.70 PPARA (0.42) FFAR1PPARDPPARG
SCHEMBL6670411 0.70 FFAR1 (0.60) FFAR1PPARD
SCHEMBL7437531 0.70 CA9 (0.40) SLC10A2CA9CA12CA1CA2
SCHEMBL10011520 0.69 PPARG (0.59) FFAR1PPARDPPARG

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-0375451-A2 Compounds having a renin-inhibiting activity BEECHAM GROUP PLC (GB) 1990-06-27 EP disclosed
EP-0350163-A2 Renin inhibitory peptides BEECHAM GROUP PLC (GB) 1990-01-10 EP disclosed