SCHEMBL9190894

SCHEMBL9190894

Cc1ccccc1S(=O)(=O)NC(=O)c1ccc2c(ccn2Cc2cccc([N+](=O)[O-])c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.47
HDAC8 Q9BY41 3/20 0.46
HDAC6 Q9UBN7 3/20 0.46
HDAC11 Q96DB2 1/20 0.46
EPHX2 P34913 2/20 0.46
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC3 O15379 2/20 0.43
HDAC1 Q13547 2/20 0.43
HDAC2 Q92769 2/20 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
SCHEMBL9184089 0.86 PLAU (0.55) PPARGHDAC8HDAC6HDAC11EPHX2
SCHEMBL9184907 0.79 PPARG (0.43) PPARGHDAC8HDAC6HDAC11EPHX2
SCHEMBL9185683 0.79 KCNQ3 (0.46) PPARGHDAC8HDAC6HDAC11EPHX2
SCHEMBL9188860 0.79 ITGB3 (0.47) PPARGHDAC8HDAC6HDAC11EPHX2
SCHEMBL9184540 0.79 PPARG (0.43) PPARGHDAC8HDAC6HDAC11EPHX2
SCHEMBL9182305 0.79 PAX8 (0.51) PPARGHDAC8HDAC6HDAC11LMNA
SCHEMBL9303677 0.79 SMN1; SMN2 (0.60) LMNASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL9185692 0.79 PPARG (0.42) PPARGHDAC8HDAC6HDAC11EPHX2
SCHEMBL9185687 0.79 PPARG (0.42) PPARGHDAC8HDAC6HDAC11EPHX2
SCHEMBL9190826 0.78 PPARG (0.43) PPARGHDAC8HDAC6HDAC11EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0476935-B1 New indol and indoline derivatives LILLY INDUSTRIES LTD (GB) 1995-07-26 EP disclosed
US-5185361-A Indole sulfonamides; Leukotriene antagonists LILLY INDUSTRIES LIMITED (GB) 1993-02-09 US disclosed
EP-0476935-A1 New indol and indoline derivatives LILLY INDUSTRIES LIMITED (GB) 1992-03-25 EP disclosed