SCHEMBL8064757

SCHEMBL8064757

Cc1c(Cl)cccc1S(=O)(=O)N1CCC(CNC(N)=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.53
DCTPP1 Q9H773 2/20 0.50
ALDH1A1 P00352 2/20 0.49
EPHX2 P34913 1/20 0.47
FAAH O00519 2/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
BDKRB2 P30411 1/20 0.45
BDKRB1 P46663 1/20 0.45

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
SCHEMBL8061058 0.82 HSD11B1 (0.49) HSD11B1
SCHEMBL5247343 0.81 HSD11B1 (0.70) HSD11B1EPHX2LMNABDKRB2BDKRB1
SCHEMBL4542938 0.81 HSD11B1 (0.51) HSD11B1DCTPP1ALDH1A1EPHX2FAAH
SCHEMBL4542937 0.80 EPHX2 (0.57) HSD11B1EPHX2
SCHEMBL8049830 0.78 HSD11B1 (0.49) HSD11B1
SCHEMBL4306300 0.77 HSD11B1 (0.69) HSD11B1ALDH1A1EPHX2LMNABDKRB2
SCHEMBL4531620 0.75 HSD11B1 (0.58) HSD11B1DCTPP1ALDH1A1EPHX2
SCHEMBL1299167 0.74 TSHR (0.68) HSD11B1ALDH1A1LMNAL3MBTL1
SCHEMBL21512378 0.73 HSD11B1 (0.49) HSD11B1DCTPP1ALDH1A1FAAHHDAC3
SCHEMBL21511373 0.73 HSD11B1 (0.49) HSD11B1DCTPP1ALDH1A1FAAHHDAC3

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-2009070497-A1 SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-06-04 WO disclosed