SCHEMBL4755251

SCHEMBL4755251

O=C(O)c1cc(S(=O)(=O)Nc2ccccc2)c(Cl)cc1NCc1ccco1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 10/20 0.77
CISD1 Q9NZ45 3/20 0.74
ALDH1A1 P00352 2/20 0.74
CA12 O43570 1/20 0.74
CA1 P00915 1/20 0.74
CA2 P00918 1/20 0.74
HTR1A P08908 1/20 0.74
CA4 P22748 1/20 0.74
CA6 P23280 1/20 0.74
HSD11B1 P28845 1/20 0.74
CA5A P35218 1/20 0.74
CA7 P43166 1/20 0.74
SLC10A1 Q14973 1/20 0.74
CA9 Q16790 1/20 0.74
GPR35 Q9HC97 1/20 0.74
CA14 Q9ULX7 1/20 0.74
ABCG2 Q9UNQ0 1/20 0.74
CA5B Q9Y2D0 1/20 0.74
TEX264 Q9Y6I9 1/20 0.66
AQP1 P29972 1/20 0.63

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
SCHEMBL29855450 1.00 APP (0.77) APPCISD1ALDH1A1CA12CA1
SCHEMBL29855566 0.87 APP (1.00) APPCISD1ALDH1A1CA12CA1
SCHEMBL12418650 0.87 APP (1.00) APPCISD1ALDH1A1CA12CA1
SCHEMBL12418656 0.87 AQP1 (0.82) APPCISD1ALDH1A1CA12CA1
SCHEMBL20369158 0.85 APP (0.81) APPCISD1ALDH1A1CA12CA1
SCHEMBL29855535 0.85 APP (0.81) APPCISD1ALDH1A1CA12CA1
SCHEMBL11929317 0.85 APP (0.82) APPCISD1ALDH1A1CA12CA1
SCHEMBL11820603 0.85 APP (0.80) APPCISD1ALDH1A1CA12CA1
SCHEMBL22852478 0.85 CISD1 (0.80) APPCISD1ALDH1A1CA12CA1
Furosemide SCHEMBL29406913 0.85 CISD1 (1.00) APPCISD1ALDH1A1CA12CA1

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-11774442-B2 Molecule sensor systems ENEVOLV, INC. (US) 2023-10-03 US disclosed
EP-4053146-A2 MOLECULE SENSOR SYSTEMS enEvolv, Inc. (US) 2022-09-07 EP disclosed
WO-2020257940-A1 FUROSEMIDE ANALOGUES AND COMPOSITIONS AND USES THEREOF FOR TREATMENT OF ALZHEIMER'S DISEASE UNIVERSITY HEALTH NETWORK (CA) 2020-12-30 WO disclosed
EP-1968603-A2 THERAPEUTIC AMINE-ARYLSULFONAMIDE CONJUGATE COMPOUNDS Algebra Inc. (US) 2008-09-17 EP disclosed
WO-2007079470-A2 THERAPEUTIC AMINE-ARYLSULFONAMIDE CONJUGATE COMPOUNDS ALGEBRA, INC. (US) 2007-07-12 WO disclosed