SCHEMBL8103054

SCHEMBL8103054

COC(=O)Oc1ncc(C(=O)O)cc1OCC(C)C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.46
NR1H4 Q96RI1 1/20 0.42
RXRA P19793 3/20 0.42
PPARG P37231 1/20 0.42
HCAR3 P49019 2/20 0.41
MYC P01106 3/20 0.41
MAX P61244 3/20 0.41
EP300 Q09472 2/20 0.41
RARA P10276 1/20 0.41
RARB P10826 1/20 0.41
RARG P13631 1/20 0.41
GCK P35557 1/20 0.41
HCAR2 Q8TDS4 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39

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
SCHEMBL8090536 0.84 PTGS2 (0.47)
SCHEMBL8786349 0.83 SCN9A (0.37) XDH
SCHEMBL8785294 0.82 XDH (0.41) XDHNR1H4RXRAPPARGMYC
SCHEMBL8875124 0.80 XDH (0.47) XDHNR1H4RXRAPPARGHCAR3
SCHEMBL8875662 0.79 XDH (0.51) XDHNR1H4RXRAPPARGHCAR3
SCHEMBL8785607 0.76 RORC (0.41) HCAR3HCAR2
SCHEMBL21191122 0.74 NR1H4 (0.46) XDHNR1H4RXRAPPARGHCAR3
SCHEMBL4948794 0.74 SCN9A (0.52) XDHNR1H4
SCHEMBL8886246 0.74 XDH (0.44) XDHRXRAPPARGHCAR3MYC
SCHEMBL8785923 0.73 AR (0.37) XDHNR1H4EP300

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0673932-B1 Sulfonamidocarbonyl-pyridine-2-carboxamides as well as their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AG (DE) 2000-06-07 EP disclosed
EP-0673931-B1 Sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AG (DE) 1997-08-13 EP disclosed
EP-0673931-A1 Sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-09-27 EP disclosed
EP-0673932-A1 Sulfonamidocarbonyl-pyridine-2-carboxamides as well as their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-09-27 EP disclosed