SCHEMBL8009035

SCHEMBL8009035

COS(=O)(=O)c1ccc(S(=O)(=O)NC(=O)C(C#N)=C2NS(=O)(=O)c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.36
KMT2A Q03164 3/20 0.34
KDM4E B2RXH2 3/20 0.34
USP2 O75604 2/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
LMNA P02545 1/20 0.34
BCHE P06276 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CA5B Q9Y2D0 1/20 0.34
MEN1 O00255 2/20 0.33
IDO1 P14902 1/20 0.33
SLC40A1 Q9NP59 1/20 0.32
PTGES O14684 1/20 0.32

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
SCHEMBL7999074 0.90 ALPL (0.43) KMT2ACA1CA2MEN1ALPL
SCHEMBL8010691 0.89 HSD11B1 (0.37) HSD11B1KMT2AKDM4EUSP2LMNA
SCHEMBL8007957 0.89 ALDH1A1 (0.41) HSD11B1KMT2AKDM4EUSP2CA12
SCHEMBL2744207 0.88 HSD11B1 (0.43) HSD11B1KMT2AKDM4EUSP2CA12
SCHEMBL8014575 0.87 HSD11B1 (0.38) HSD11B1KMT2AKDM4EUSP2CA12
SCHEMBL8010715 0.87 CA12 (0.40) HSD11B1KMT2AKDM4EUSP2CA12
SCHEMBL7998459 0.86 CA1 (0.38) HSD11B1KMT2AKDM4EUSP2CA12
SCHEMBL8011292 0.86 KMT2A (0.41) HSD11B1KMT2AKDM4EUSP2CA12
SCHEMBL8008055 0.86 FLT1 (0.41) HSD11B1KMT2AMEN1PTGESALPL
SCHEMBL7998786 0.84 HSD11B1 (0.36) HSD11B1KMT2AKDM4EUSP2CA12

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
US-6165668-A N-[2-(1,2-benzisothiazol-3(2H)-ylidene 1,1-dioxide)-2-cyanoacetyl]benzenesulfonamide charge control agents for electrostatographic toners and developers EASTMAN KODAK COMPANY (US) 2000-12-26 US disclosed