SCHEMBL14744152

SCHEMBL14744152

O=C(O)Cc1ccc(S(=O)(=O)CCCOCc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
AKR1B1 P15121 1/20 0.46
ALDH1A1 P00352 3/20 0.43
HTT P42858 2/20 0.43
TSHR P16473 2/20 0.42
HSD17B10 Q99714 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
RORC P51449 2/20 0.42
ABCC4 O15439 1/20 0.41
GAA P10253 1/20 0.41
PTGS1 P23219 1/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
CA2 P00918 1/20 0.40
CAMK2A Q9UQM7 1/20 0.40

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
SCHEMBL14744364 0.87 ALDH1A1 (0.49) LMNAALDH1A1HTTTSHRHSD17B10
SCHEMBL10759014 0.87 LMNA (0.48) LMNAALDH1A1HTTHDAC1HDAC8
SCHEMBL10755015 0.79 LMNA (0.50) LMNAALDH1A1HTTRORCKDM4E
SCHEMBL9813753 0.78 HDAC1 (0.64) LMNAAKR1B1ALDH1A1HTTTSHR
SCHEMBL10581074 0.77 HDAC1 (0.58) LMNAAKR1B1ALDH1A1HTTTSHR
SCHEMBL1128420 0.77 KCNH2 (0.51) LMNAALDH1A1HTTTSHRHSD17B10
SCHEMBL26978769 0.77 LMNA (0.56) LMNAALDH1A1GAAL3MBTL1TDP1
SCHEMBL31277779 0.76 TSHR (0.50) LMNAALDH1A1HTTTSHRL3MBTL1
SCHEMBL23193744 0.75 ALDH1A1 (0.64) ALDH1A1HTTHSD17B10RORCKDM4E
SCHEMBL163450 0.75 HTT (0.51) LMNAAKR1B1ALDH1A1HTTTSHR

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
WO-2013029338-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-03-07 WO disclosed