SCHEMBL27380654

SCHEMBL27380654

N=C(N)NOS(=O)(=O)CC(=O)c1cccc(-c2ccc(Cl)s2)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 7/20 0.39
HSD17B2 P37059 6/20 0.39
KLKB1 P03952 2/20 0.38
PRSS1 P07477 1/20 0.38
TMPRSS15 P98073 1/20 0.38
PFKFB3 Q16875 1/20 0.38
F10 P00742 1/20 0.36
HSD11B1 P28845 1/20 0.36
EPHX2 P34913 1/20 0.35
CNR1 P21554 2/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HPGDS O60760 1/20 0.35
IKBKB O14920 1/20 0.34
NQO2 P16083 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
SCHEMBL27361121 0.84 PFKFB3 (0.36) PRSS1PFKFB3F10
SCHEMBL8703824 0.83 KAT6A (0.46) F10IKBKB
SCHEMBL27379215 0.83 ERCC5 (0.34) PRSS1F10HDAC1HDAC6
SCHEMBL27400468 0.80 KAT6A (0.35) PRSS1F10HSD11B1
SCHEMBL27379218 0.80 CYP2A6 (0.34) PRSS1PFKFB3F10
SCHEMBL27363614 0.80 TBXA2R (0.35) F10HSD11B1HDAC1HDAC6HPGDS
SCHEMBL27452727 0.78 KAT6A (0.33) PRSS1F10HSD11B1
SCHEMBL8699108 0.76 SERPINE1 (0.39) PRSS1CNR1HDAC1
SCHEMBL27380656 0.76 KLKB1 (0.43) HSD17B1HSD17B2KLKB1PRSS1TMPRSS15
SCHEMBL27334381 0.75 MAPT (0.44) HSD11B1HDAC1

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
CN-1070173-C Benzoylguanidine derivatives as medicaments FUJISAWA PHARMACEUTICAL CO (JP) 2001-08-29 CN disclosed
CN-1158606-A Benzoylguanidine derivatives as medicaments FUJISAWA PHARMACEUTICAL CO (JP) 1997-09-03 CN disclosed