SCHEMBL9526580

SCHEMBL9526580

CC(=O)C(c1ccccc1S(N)(=O)=O)C(C)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 14/20 0.42
CA2 P00918 14/20 0.42
CA9 Q16790 8/20 0.42
CA5A P35218 3/20 0.41
CA12 O43570 4/20 0.38
CA6 P23280 3/20 0.38
CA4 P22748 2/20 0.38
CA7 P43166 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
CYP2C9 P11712 2/20 0.38
CA14 Q9ULX7 1/20 0.38
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP12 P39900 1/20 0.35
MMP13 P45452 1/20 0.35
MMP14 P50281 1/20 0.35
MMP16 P51512 1/20 0.35
MCL1 Q07820 1/20 0.35

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
SCHEMBL8107414 0.78 CA1 (0.41) CA1CA2CA9CA5ACA12
SCHEMBL9526615 0.75 CA1 (0.42) CA1CA2CA9CA5ACA12
SCHEMBL3284628 0.74 HTR2A (0.48) CA1CA2CA9CA5ACA12
SCHEMBL1106519 0.74 CA1 (0.53) CA1CA2CA9CA5ACA12
SCHEMBL21826752 0.74 CA2 (0.50) CA1CA2CA9CA5ACA12
SCHEMBL30593603 0.74 CA1 (0.53) CA1CA2CA9CA5ACA12
SCHEMBL29933194 0.74 CA2 (0.50) CA1CA2CA9CA5ACA12
SCHEMBL7351490 0.73 MMP2 (0.60) CA1CA2CA9CA5ACA12
SCHEMBL9524316 0.73 CA1 (0.42) CA1CA2CA9CA5ACA12
Potassium SCHEMBL9493381 0.72 CA1 (0.51) 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 2 patents. 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 claimed
WO-1992015568-A1 BENZENESULFONYLUREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-09-17 WO claimed