SCHEMBL14423923

SCHEMBL14423923

CCBc1ccc(NS(=O)(=O)c2cccc(C(=O)O)c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
ALDH1A1 P00352 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
GFER P55789 1/20 0.56
MAPT P10636 2/20 0.54
HSD17B10 Q99714 2/20 0.54
PFKFB3 Q16875 1/20 0.53
HSPD1 P10809 1/20 0.53
HSPE1 P61604 1/20 0.53
HDAC2 Q92769 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
PTPN1 P18031 1/20 0.50
PTPN6 P29350 1/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
TSHR P16473 1/20 0.50

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
SCHEMBL4063367 0.81 PFKFB3 (0.76) AKR1C3MEN1KMT2AGFERMAPT
SCHEMBL30702319 0.81 PFKFB3 (0.76) AKR1C3MEN1KMT2AGFERMAPT
SCHEMBL30702318 0.81 PFKFB3 (0.76) AKR1C3MEN1KMT2AGFERMAPT
SCHEMBL7375504 0.80 MEN1 (0.65) AKR1C3MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL14680112 0.79 KMT2A (0.60) AKR1C3MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL4253424 0.79 MEN1 (0.79) AKR1C3MEN1KMT2AGFERMAPT
SCHEMBL7366821 0.79 AKR1C3 (0.67) AKR1C3MEN1KMT2AGFERMAPT
SCHEMBL14659760 0.78 MEN1 (0.65) AKR1C3MEN1KMT2AALDH1A1GFER
SCHEMBL14423939 0.76 HDAC1 (0.44) MEN1KMT2AALDH1A1MAPTHDAC2
SCHEMBL16020318 0.76 AKR1C3 (0.53) AKR1C3MEN1KMT2AALDH1A1L3MBTL1

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
US-7262318-B2 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER, INC. (US) 2007-08-28 US disclosed