SCHEMBL6204418

SCHEMBL6204418

CC(=O)c1ccccc1NS(=O)(=O)CC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
KDM4E B2RXH2 3/20 0.44
MAPK1 P28482 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
RAB9A P51151 2/20 0.44
AGTR1 P30556 1/20 0.44
KCNA5 P22460 2/20 0.44
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
RECQL P46063 1/20 0.43
BDKRB1 P46663 1/20 0.43
ELANE P08246 1/20 0.42
PRTN3 P24158 1/20 0.42
HPGD P15428 4/20 0.42
MEN1 O00255 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
CES1 P23141 1/20 0.42

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
SCHEMBL6204310 0.78 KEAP1 (0.51) KMT2ALMNARAB9AAKR1C3AKR1C2
SCHEMBL6202161 0.76 HPGD (0.56) KMT2AKDM4EMAPK1SMN1; SMN2LMNA
SCHEMBL6203398 0.74 LMNA (0.60) KMT2AKDM4EMAPK1SMN1; SMN2LMNA
SCHEMBL9624375 0.74 KMT2A (0.67) KMT2AKDM4EMAPK1SMN1; SMN2ELANE
SCHEMBL2201197 0.73 ELANE (0.64) KMT2AKDM4EMAPK1SMN1; SMN2LMNA
SCHEMBL6205498 0.73 RECQL (0.60) KMT2ASMN1; SMN2LMNARAB9ARECQL
SCHEMBL27182604 0.71 ELANE (0.51) KMT2AKDM4EMAPK1SMN1; SMN2LMNA
SCHEMBL222372 0.71 KCNA5 (0.61) KMT2AKDM4ELMNAKCNA5HPGD
SCHEMBL8996748 0.71 KMT2A (0.65) KMT2AKDM4EMAPK1SMN1; SMN2LMNA
SCHEMBL14397868 0.70 ALDH1A1 (0.61) KMT2AKDM4EMAPK1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549600-A1 KETONES AstraZeneca AB (SE) 2005-07-06 EP claimed
WO-2004011410-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-02-05 WO claimed
US-20050272036-A1 Ketones ASTRAZENECA AB (SE) 2005-12-08 US disclosed
EP-1549600-A1 KETONES AstraZeneca AB (SE) 2005-07-06 EP disclosed
WO-2004011410-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-02-05 WO disclosed