SCHEMBL4734975

SCHEMBL4734975

Cc1cc2c(cc1S(=O)(=O)NCCc1ccccn1)Sc1ccccc1C21CCCC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
PRMT5 O14744 9/20 0.41
WDR77 Q9BQA1 9/20 0.41
RAB9A P51151 1/20 0.39
RIOK1 Q9BRS2 1/20 0.38

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
SCHEMBL4735297 0.99 MEN1 (0.44) MEN1KMT2AKDM4EMAPTPRMT5
SCHEMBL4732751 0.86 MEN1 (0.44) MEN1KMT2A
SCHEMBL4731938 0.83 POLB (0.45) PRMT5WDR77
SCHEMBL4729666 0.81 MEN1 (0.44) MEN1KMT2AKDM4EMAPTPRMT5
SCHEMBL4798309 0.80 MEN1 (0.44) MEN1KMT2AKDM4EMAPTPRMT5
SCHEMBL29451524 0.72 MEN1 (0.60) MEN1KMT2AKDM4EMAPTPRMT5
SCHEMBL4731649 0.71 HTT (0.38) MEN1KMT2AMAPT
SCHEMBL4616670 0.71 MEN1 (0.56) MEN1KMT2AKDM4EMAPTPRMT5
SCHEMBL4617021 0.70 MEN1 (0.59) MEN1KMT2AKDM4EMAPTPRMT5
SCHEMBL4735086 0.70 ALOX5AP (0.36) MEN1KMT2AKDM4EMAPT

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
WO-2008061029-A1 ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO claimed