SCHEMBL9523787

SCHEMBL9523787

CC(=O)OC(F)Cc1ccccc1S(N)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 13/20 0.41
CA2 P00918 13/20 0.41
CA9 Q16790 6/20 0.41
CA5A P35218 2/20 0.41
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
CA12 O43570 3/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CYP2C9 P11712 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
PTGES2 Q9H7Z7 2/20 0.35
NQO2 P16083 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
CSF1R P07333 1/20 0.34
MAPK1 P28482 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
SCHEMBL9523006 0.81 MAPT (0.37)
SCHEMBL9020911 0.79 CA2 (0.33) CA2
SCHEMBL9288190 0.79 CA1 (0.38) CA1CA2CA9CA5ACA12
SCHEMBL9216148 0.79 MMP2 (0.33) CYP2C9NQO2MTNR1AMTNR1B
SCHEMBL9526585 0.78 CA1 (0.40) CA1CA2CA9CA5ACA12
SCHEMBL9020962 0.78 CA2 (0.32) CA1CA2CA9CA5A
SCHEMBL11123277 0.74 ALDH1A1 (0.49) CA1CA2CA9CA5ACA12
SCHEMBL28094519 0.74 CA2 (0.41) CA1CA2CA9CA5ACA12
SCHEMBL27961605 0.73 PTGES2 (0.43) CA1CA2CA9CA5ACA12
SCHEMBL674104 0.73 CA2 (0.45) CA1CA2CA9CA5ACA12

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-0575378-A1 BENZENESULFONYLUREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-12-29 EP disclosed