SCHEMBL8103050

SCHEMBL8103050

COc1cc(C(=O)NS(=O)(=O)c2ccc(C(=O)NC3CCCCC3)cc2)cnc1OC(=O)NCC(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
TSHR P16473 3/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 4/20 0.42
HPGD P15428 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PPARG P37231 2/20 0.41
CYSLTR1 Q9Y271 2/20 0.41
EPHX2 P34913 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ABCC3 O15438 1/20 0.41
ABCC4 O15439 1/20 0.41
ABCC9 O60706 1/20 0.41
ABCB11 O95342 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL8768279 0.90 LMNA (0.42) LMNATSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL8874939 0.89 LMNA (0.44) LMNATSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL8768360 0.89 L3MBTL1 (0.50) LMNATSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL8104049 0.87 LMNA (0.39) LMNATSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL8097853 0.83 LMNA (0.49) LMNATSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL8868742 0.83 LMNA (0.48) LMNATSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL8767110 0.82 LMNA (0.40) LMNATSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL8104048 0.81 PTGS2 (0.44) SMN1; SMN2KMT2A
SCHEMBL8767453 0.80 LMNA (0.42) LMNATSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL8874675 0.79 L3MBTL1 (0.43) LMNATSHRHTTSMN1; SMN2ALDH1A1

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-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-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