SCHEMBL7588947

SCHEMBL7588947

Cc1cccc(S(=O)(=O)Nc2cc(Br)c(Br)cc2NS(=O)(=O)c2cccc(C)c2)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
ALDH1A1 P00352 3/20 0.57
MEN1 O00255 2/20 0.57
MAPT P10636 2/20 0.57
LMNA P02545 2/20 0.57
KDM4E B2RXH2 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
EDNRA P25101 2/20 0.56
EDNRB P24530 1/20 0.56
SLC40A1 Q9NP59 1/20 0.56
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.49
RAD52 P43351 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
FBP1 P09467 1/20 0.49

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
SCHEMBL7594368 0.83 WDR5 (0.60) KMT2AMEN1EDNRAEDNRB
SCHEMBL7571512 0.83 KMT2A (0.60) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL5956125 0.81 ALDH1A1 (0.59) ALDH1A1MAPTLMNAHTT
SCHEMBL28636424 0.80 KMT2A (0.65) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL9266314 0.78 PTGES2 (0.70) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL7901144 0.78 KMT2A (0.62) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL15045213 0.77 KMT2A (0.71) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL7591899 0.76 KMT2A (0.61) KMT2AMEN1LMNASLC40A1HDAC1
SCHEMBL6920158 0.76 KMT2A (0.69) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL25495354 0.76 EDNRA (0.55) KMT2AALDH1A1MEN1MAPTLMNA

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-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 WO disclosed