SCHEMBL8136644

SCHEMBL8136644

NC(=O)C1c2ccccc2CC1(N[S+]([O-])c1ccc(Oc2ccc(F)cc2)cc1)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.35
BCL2L1 Q07817 1/20 0.34
MCL1 Q07820 1/20 0.34
SCN3A Q9NY46 2/20 0.32
FPR2 P25090 1/20 0.32
SCN9A Q15858 3/20 0.32
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
EPHX2 P34913 2/20 0.31
LTA4H P09960 1/20 0.31
SCN4A P35499 1/20 0.31
BTK Q06187 2/20 0.31
F13A1 P00488 2/20 0.31
TGM2 P21980 2/20 0.31
BACE1 P56817 1/20 0.31
ALOX5 P09917 1/20 0.31
MMP1 P03956 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL6962253 0.82 MMP1 (0.46) BCL2L1MCL1FFAR1FFAR4MMP1
SCHEMBL12386985 0.57 LTA4H (0.50) BCL2L1MCL1SCN9AFFAR1FFAR4
SCHEMBL15742443 0.56 MAPT (0.38)
SCHEMBL15910197 0.56 HSPB1 (0.48) KCNH2SCN9AFFAR1FFAR4EPHX2
SCHEMBL6070160 0.56 GRM2 (0.38)
SCHEMBL255272 0.56 LTA4H (0.67) SCN9AFFAR1FFAR4EPHX2LTA4H
SCHEMBL19852061 0.55 ALDH1A1 (0.40)
Methylamine SCHEMBL28014353 0.55 LTA4H (0.57) SCN9AFFAR1FFAR4EPHX2LTA4H
SCHEMBL9814841 0.54 SRD5A2 (0.72) BCL2L1MCL1LTA4H
SCHEMBL19629839 0.54 KMT2A (0.41) MMP1MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0977733-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES Pfizer Products Inc. (US) 2000-02-09 EP disclosed
WO-1998033768-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-08-06 WO disclosed