SCHEMBL8355111

SCHEMBL8355111

O=[N+]([O-])c1cccc(-c2csc(NS(=O)(=O)Cc3ccccc3)n2)c1

nearest known ligand 0.75

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.65
KMT2A Q03164 5/20 0.65
CSNK2A1 P68400 2/20 0.64
KDM1A O60341 2/20 0.64
MAPT P10636 3/20 0.63
ALDH1A1 P00352 2/20 0.63
GAA P10253 1/20 0.63
RAB9A P51151 1/20 0.63
POLB P06746 1/20 0.61
KMO O15229 1/20 0.61
KDM4E B2RXH2 1/20 0.57
MAPK1 P28482 1/20 0.57
HTT P42858 1/20 0.57
MAOA P21397 2/20 0.56
MAOB P27338 2/20 0.56
VCP P55072 1/20 0.55

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
SCHEMBL3673316 0.86 KDM1A (0.80) MEN1KMT2ACSNK2A1KDM1AMAPT
SCHEMBL2762558 0.85 MEN1 (0.77) MEN1KMT2ACSNK2A1KDM1AMAPT
SCHEMBL8359224 0.85 MEN1 (0.64) MEN1KMT2ACSNK2A1KDM1AMAPT
SCHEMBL5966304 0.82 KDM1A (0.66) MEN1KMT2ACSNK2A1KDM1AMAPT
SCHEMBL27182617 0.82 KDM1A (0.68) MEN1KMT2ACSNK2A1KDM1AMAPT
SCHEMBL6435702 0.80 KDM1A (0.66) MEN1KMT2ACSNK2A1KDM1AMAPT
SCHEMBL2762482 0.80 KDM1A (0.68) MEN1KMT2AKDM1AMAPTPOLB
SCHEMBL8355083 0.80 KDM1A (0.84) MEN1KMT2AKDM1APOLBKMO
SCHEMBL728110 0.80 KDM1A (0.74) MEN1KMT2AKDM1AMAPTPOLB
SCHEMBL727088 0.80 KDM1A (0.74) MEN1KMT2ACSNK2A1KDM1AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958910-A Use of N-(4-aryl-thiazol-2-yl)-sulfonamides HOFFMANN-LA ROCHE INC. (US) 1999-09-28 US disclosed
US-5877193-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS HOFFMANN-LA ROCHE INC. (US) 1999-03-02 US disclosed
EP-0819681-A2 N-(4-Aryl-thiazol-2-yl)-sulfonamides and their use F. HOFFMANN-LA ROCHE AG (CH) 1998-01-21 EP disclosed