SCHEMBL7572951

SCHEMBL7572951

O=C(NCc1ccc(S(=O)(=O)Nc2ccccc2NS(=O)(=O)c2cccc(C(F)(F)F)c2)s1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
GAA P10253 2/20 0.54
MAPT P10636 4/20 0.52
LMNA P02545 3/20 0.52
RAB9A P51151 1/20 0.52
CCKBR P32239 1/20 0.50
NPSR1 Q6W5P4 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ACLY P53396 1/20 0.48
KAT6A Q92794 1/20 0.46
CCR2 P41597 1/20 0.46
HTT P42858 1/20 0.45
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.44
ERAP1 Q9NZ08 1/20 0.44
ALDH1A1 P00352 1/20 0.43
ELANE P08246 1/20 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
SCHEMBL7573141 0.92 LMNA (0.49) KMT2AMEN1GAAMAPTLMNA
SCHEMBL12334073 0.82 CCKBR (0.49) KMT2AMEN1MAPTLMNARAB9A
SCHEMBL7595111 0.79 GAA (0.47) KMT2AMEN1GAAMAPTLMNA
SCHEMBL7591796 0.78 CCR2 (0.46) KMT2AMEN1GAAMAPTLMNA
SCHEMBL12334053 0.75 NR1H3 (0.54) KMT2AMEN1MAPTLMNACCKBR
SCHEMBL7592771 0.75 MEN1 (0.74) KMT2AMEN1GAALMNANPSR1
SCHEMBL4470291 0.74 SLC40A1 (0.57) KMT2AMEN1RAB9ACCKBRNPSR1
SCHEMBL12334668 0.74 CCKBR (0.46) KMT2AMEN1GAAMAPTLMNA
SCHEMBL8013271 0.73 CCKBR (0.49) KMT2AMEN1MAPTCCKBRHTT
SCHEMBL7572596 0.73 MEN1 (0.67) KMT2AMEN1GAAMAPTLMNA

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