SCHEMBL8655683

SCHEMBL8655683

NC(CO)C(I)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.42
F2 P00734 1/20 0.42
TRPA1 O75762 2/20 0.39
HTR2A P28223 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
TACR1 P25103 2/20 0.39
GSR P00390 1/20 0.39
ADRA2A P08913 1/20 0.39
ADRA2C P18825 1/20 0.39
LMNA P02545 1/20 0.39
HIF1A Q16665 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL1667437 0.78 GABBR2 (0.52) DPP4F2
SCHEMBL2126869 0.77 TACR1 (0.50) DPP4F2TRPA1HTR2ATAAR1
SCHEMBL2126865 0.77 TACR1 (0.50) DPP4F2TRPA1HTR2ATAAR1
SCHEMBL5043328 0.76 KDM4E (0.56) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL15916220 0.76 KDM4E (0.56) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL605463 0.76 KDM4E (0.56) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL2065907 0.76 KDM4E (0.56) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL147622 0.76 KDM4E (0.56) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL3363663 0.76 KDM4E (0.56) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL1162359 0.76 KDM4E (0.56) DPP4F2ADRA2AADRA2CLMNA

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-0842148-A1 BENZENESULPHONAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USES THEREOF SYNTHELABO (FR) 1998-05-20 EP disclosed
WO-1997006136-A1 BENZENESULPHONAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USES THEREOF SYNTHELABO (FR) 1997-02-20 WO disclosed