SCHEMBL1876455

SCHEMBL1876455

O=C1NCCCC1NS(=O)(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP13 P45452 1/20 0.47
MMP14 P50281 1/20 0.47
ALOX5AP P20292 4/20 0.46
FEN1 P39748 4/20 0.46
ALDH1A1 P00352 6/20 0.46
USP2 O75604 1/20 0.46
NPSR1 Q6W5P4 1/20 0.43
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43
CYP1A2 P05177 1/20 0.43
THRB P10828 1/20 0.43
KDM4E B2RXH2 2/20 0.42
MCOLN2 Q8IZK6 1/20 0.42

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
SCHEMBL1873720 1.00 BACE1 (0.47) BACE1MMP2MMP9MMP13MMP14
SCHEMBL1877899 0.95 ALDH1A1 (0.51) BACE1MMP2MMP9MMP13MMP14
SCHEMBL1876072 0.95 ALDH1A1 (0.51) BACE1MMP2MMP9MMP13MMP14
SCHEMBL1876365 0.91 USP2 (0.48) BACE1MMP2MMP9MMP13MMP14
SCHEMBL15172004 0.91 USP2 (0.48) BACE1MMP2MMP9MMP13MMP14
SCHEMBL1871813 0.91 USP2 (0.48) BACE1MMP2MMP9MMP13MMP14
SCHEMBL14855604 0.85 RB1 (0.49) BACE1MMP2MMP9MMP13ALOX5AP
SCHEMBL14855597 0.85 ALDH1A1 (0.54) BACE1MMP2MMP9MMP13ALDH1A1
SCHEMBL14856021 0.85 ALDH1A1 (0.54) BACE1MMP2MMP9MMP13ALDH1A1
SCHEMBL14855603 0.85 RB1 (0.49) BACE1MMP2MMP9MMP13ALOX5AP

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110212920-A1 N-Substituted Benzene Sulfonamides NEITZEL MARTIN 2011-09-01 US disclosed
US-7939657-B2 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2011-05-10 US disclosed
US-20070191341-A1 N-Substituted Benzene Sulfonamides ELAN PHARMACEUTICALS, INC. 2007-08-16 US disclosed
US-7208488-B2 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2007-04-24 US disclosed
US-20050165003-A1 Treating Alzheimer's Disease; 4-Chloro-N-(4-hydroxy-3-methoxy-benzyl)-N-(2-oxo-azepan-3-yl)-benzenesulfonamide for example; gamma secretase inhibitors; inhibition of beta-amyloid synthesis with minimal inhibition of Notch Signaling ELAN PHARMACEUTICALS, INC. 2005-07-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050165003-A1 Treating Alzheimer's Disease; 4-Chloro-N-(4-hydroxy-3-methoxy-benzyl)-N-(2-oxo-azepan-3-yl)-benzenesulfonamide for example; gamma secretase inhibitors; inhibition of beta-amyloid synthesis with minimal inhibition of Notch Signaling BACE1, PSEN1, BACE2 BACE1 1/4885MMP2 2913/4885MMP9 1767/4885
US-20070191341-A1 N-Substituted Benzene Sulfonamides PSEN1, PSEN2, BACE1 BACE1 3/4885MMP2 3969/4885MMP9 3889/4885
US-20110212920-A1 N-Substituted Benzene Sulfonamides PSEN1, PSEN2, BACE1 BACE1 3/4885MMP2 3969/4885MMP9 3889/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.