SCHEMBL2582089

SCHEMBL2582089

COc1ccc(-c2ccc(C)c(N)c2)nc1.Cc1ccc(-n2cccc2)cc1NS(=O)(=O)c1ccn(C)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.47
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
BLM P54132 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPY5R Q15761 3/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KEAP1 Q14145 1/20 0.35
POLB P06746 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GHSR Q92847 1/20 0.35
PTGER4 P35408 1/20 0.34

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
SCHEMBL2119228 0.87 MAPT (0.54) MAPTALDH1A1KDM4EPKMCYP2C9
SCHEMBL2119501 0.79 KMT2A (0.48) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL2119833 0.76 MAPT (0.52) MAPTALDH1A1KDM4EPKMCYP2C9
SCHEMBL2117300 0.76 MAPT (0.46) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL2119462 0.75 LMNA (0.55) MAPTALDH1A1PKMCYP2C9TSHR
SCHEMBL2116904 0.73 LMNA (0.41) MAPTALDH1A1KDM4EPKMNPY5R
SCHEMBL2122365 0.72 MAPT (0.43) MAPTTP53SMN1; SMN2
SCHEMBL2119523 0.71 MAPT (0.50) MAPTALDH1A1PKMCYP2C9TSHR
SCHEMBL2119248 0.71 MAPT (0.48) MAPTALDH1A1MEN1KMT2APKM
SCHEMBL2116839 0.71 MAPT (0.48) MAPTALDH1A1MEN1KMT2AKDM4E

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
EP-2382190-A1 TOLUIDINE SULFONAMIDES AND THEIR USE AS-INHIBITORS European Molecular Biology Laboratory (EMBL) (DE) 2011-11-02 EP disclosed