SCHEMBL6601106

SCHEMBL6601106

COc1nn(-c2ccc(NS(=O)(=O)c3cccc4cccnc34)cc2)c(=O)o1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.62
HTT P42858 1/20 0.62
ALDH1A1 P00352 3/20 0.56
GFER P55789 1/20 0.55
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
GAA P10253 2/20 0.54
PKM P14618 3/20 0.50
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.49
HDAC1 Q13547 1/20 0.48
GHSR Q92847 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPT P10636 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TSHR P16473 1/20 0.47
PKLR P30613 1/20 0.47

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
SCHEMBL7040692 0.81 MGLL (0.53) ALDH1A1TDP1HDAC1MAPT
SCHEMBL22422345 0.77 TP53 (1.00) TP53HTTALDH1A1GFERMEN1
SCHEMBL7045584 0.75 PGR (0.58) ALDH1A1KMT2APKMTDP1MAPT
SCHEMBL10192086 0.73 MEN1 (0.75) TP53HTTALDH1A1GFERMEN1
SCHEMBL7040759 0.73 ABHD16A (0.58)
SCHEMBL6599976 0.72 LMNA (0.56) HTTALDH1A1MEN1KMT2APKM
SCHEMBL6363732 0.72 GFER (0.98) TP53HTTALDH1A1GFERMEN1
SCHEMBL17210223 0.72 ALDH1A1 (1.00) TP53HTTALDH1A1MEN1KMT2A
SCHEMBL6362807 0.71 GFER (1.00) TP53HTTALDH1A1GFERMEN1
SCHEMBL7043957 0.71 MGLL (0.52) GHSR

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
EP-1263745-B1 SUBSTITUTED 3-PHENYL-5-ALKOXI-1,3,4-OXDIAZOL-2-ONE AND USE THEREOF FOR INHIBITING HORMONE-SENSITIVE LIPASE AVENTIS PHARMA GMBH (DE) 2004-05-19 EP disclosed