SCHEMBL27767604

SCHEMBL27767604

NC(CC(=O)O)S(=O)(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.43
GABBR1 Q9UBS5 1/20 0.43
ALDH1A1 P00352 2/20 0.42
SLC1A3 P43003 2/20 0.41
SLC1A2 P43004 2/20 0.41
SLC1A1 P43005 2/20 0.41
MMP1 P03956 3/20 0.41
MMP7 P09237 3/20 0.41
MMP12 P39900 3/20 0.41
MMP13 P45452 3/20 0.41
ACE P12821 2/20 0.41
LARS1 Q9P2J5 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40

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
SCHEMBL27625448 0.87 ALDH1A1 (0.41) ALDH1A1SLC1A3SLC1A2SLC1A1MMP1
SCHEMBL27560669 0.81 MMP13 (0.44) ALDH1A1SLC1A3SLC1A2SLC1A1MMP1
SCHEMBL27853852 0.81 ALDH1A1 (0.44) ALDH1A1MMP1MMP7MMP12MMP13
SCHEMBL27183172 0.81 ADAMTS4 (0.45) ALDH1A1MMP1MMP7MMP12MMP13
SCHEMBL8732760 0.78 CA12 (0.44) ALDH1A1SLC1A3SLC1A2SLC1A1LARS1
SCHEMBL2453682 0.78 KEAP1 (0.42) ALDH1A1CA12CA1CA2CA4
SCHEMBL11208829 0.77 ALDH1A1 (0.42) GABBR2GABBR1ALDH1A1MMP1MMP7
SCHEMBL28303944 0.77 MMP2 (0.43) ALDH1A1MMP1MMP7MMP12MMP13
SCHEMBL11147306 0.77 ALDH1A1 (0.42) GABBR2GABBR1ALDH1A1MMP1MMP7
Hydrochloric Acid SCHEMBL29141929 0.76 CA12 (0.43) ALDH1A1SLC1A3SLC1A2SLC1A1LARS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102471260-B Novel benzenesulfonamide compounds, method for synthesizing same, and use thereof in medicine as well as in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-10-22 CN disclosed
CN-102471260-A Novel benzenesulfonamide compounds, process for their synthesis and their use in pharmaceuticals and cosmetics GALDERMA RES & DEV 2012-05-23 CN disclosed
CN-101472892-A Organic compounds NOVARTIS AG (CH) 2009-07-01 CN disclosed