SCHEMBL5517846

SCHEMBL5517846

CC1(C)OB(c2ccc(Cc3ccccc3S(N)(=O)=O)cc2)OC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 9/20 0.48
CA2 P00918 9/20 0.48
CA9 Q16790 9/20 0.48
CA12 O43570 1/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA14 Q9ULX7 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
LPL P06858 7/20 0.46
LIPG Q9Y5X9 7/20 0.46
F11 P03951 1/20 0.44
ESR2 Q92731 1/20 0.39

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
SCHEMBL29087814 0.79 CA1 (0.49) CA1CA2CA9CA12CA3
SCHEMBL22091132 0.76 CA1 (0.50) CA1CA2CA9CA12CA3
SCHEMBL4662818 0.75 CA2 (0.47) CA1CA2CA9CA12CA3
SCHEMBL14165539 0.75 LIPG (0.65) LPLLIPGF11ESR2
SCHEMBL30988956 0.75 CA2 (0.50) CA1CA2CA9CA12CA4
SCHEMBL407413 0.75 CA2 (0.50) CA1CA2CA9CA12CA4
SCHEMBL15432466 0.74 LPL (0.69) CA1CA2CA9CA12CA3
SCHEMBL790052 0.74 CA1 (0.58) CA1CA2CA9CA12CA3
Hydrochloric Acid SCHEMBL3517386 0.73 CA1 (0.49) CA1CA2CA9CA12CA4
Methane SCHEMBL28850761 0.73 CA2 (0.49) CA1CA2CA9CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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 CA1 839/4885CA2 3100/4885CA9 2745/4885

“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.