SCHEMBL8069484

SCHEMBL8069484

NC(=O)CC1CCCN1S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.62
PSEN2 P49810 3/20 0.62
APH1B Q8WW43 3/20 0.62
NCSTN Q92542 3/20 0.62
APH1A Q96BI3 3/20 0.62
PSENEN Q9NZ42 3/20 0.62
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PAX8 Q06710 1/20 0.49
HTR7 P34969 1/20 0.49
TSHR P16473 2/20 0.49
HCRTR1 O43613 1/20 0.49
HCRTR2 O43614 1/20 0.49
LMNA P02545 1/20 0.49
CASP1 P29466 1/20 0.49
POLB P06746 1/20 0.48
CYP3A4 P08684 1/20 0.48
MEN1 O00255 1/20 0.48

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
SCHEMBL8051860 0.87 RAB9A (0.53) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8051885 0.82 BDKRB1 (0.53) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9893067 0.81 PSEN1 (0.92) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5686141 0.80 BRD4 (0.60) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5686148 0.80 BRD4 (0.60) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5250378 0.80 PSEN1 (0.75) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5915289 0.78 PSEN1 (0.69) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8064639 0.78 KDM4E (0.50) USP2ALDH1A1HPGDTSHRLMNA
SCHEMBL8060028 0.78 HTR7 (0.61) HTR7CYP3A4
SCHEMBL4542928 0.77 LMNA (0.55) PSEN1PSEN2APH1BNCSTNAPH1A

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