SCHEMBL14735835

SCHEMBL14735835

[CH2]c1ccc(S(=O)(=O)c2cccc(C)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
GAA P10253 2/20 0.48
ABCC9 O60706 1/20 0.48
ABCC8 Q09428 1/20 0.48
KCNJ11 Q14654 1/20 0.48
KCNJ8 Q15842 1/20 0.48
KMT2A Q03164 4/20 0.47
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 1/20 0.46
NAMPT P43490 4/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
PKM P14618 1/20 0.43
LMNA P02545 1/20 0.42
MEN1 O00255 2/20 0.41
HTR6 P50406 2/20 0.41

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
SCHEMBL31038387 0.86 GAA (0.67) HTTL3MBTL1TDP1GAAABCC9
SCHEMBL6151129 0.86 GAA (0.67) HTTL3MBTL1TDP1GAAABCC9
SCHEMBL822302 0.86 KMT2A (0.59) HTTL3MBTL1TDP1GAAABCC9
SCHEMBL29468572 0.86 KMT2A (0.59) HTTL3MBTL1TDP1GAAABCC9
SCHEMBL3884518 0.84 HTR6 (0.61) HTTL3MBTL1TDP1GAAABCC9
Hydrochloric Acid SCHEMBL11279258 0.84 KMT2A (0.57) HTTL3MBTL1TDP1GAAABCC9
SCHEMBL15607666 0.84 KMT2A (0.57) HTTL3MBTL1TDP1GAAABCC9
SCHEMBL9788125 0.81 RAPGEF4 (0.56) HTTL3MBTL1TDP1GAAABCC9
SCHEMBL20198361 0.81 ALDH1A1 (0.54) HTTL3MBTL1TDP1GAAABCC9
SCHEMBL18454126 0.81 HTT (0.50) HTTL3MBTL1TDP1GAAABCC9

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
EP-2565185-A1 [5,6]HETEROCYCLIC COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-03-06 EP disclosed