SCHEMBL141383

SCHEMBL141383

CS(=O)(=O)Nc1ccc2cc(S(=O)(=O)O)ccc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.61
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
BRPF1 P55201 1/20 0.50
ATM Q13315 1/20 0.47
ALDH1A1 P00352 5/20 0.46
LMNA P02545 3/20 0.46
GAA P10253 2/20 0.46
MAPK1 P28482 1/20 0.46
PKM P14618 1/20 0.45
PKLR P30613 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
CYP2C9 P11712 2/20 0.45
MAPT P10636 1/20 0.45
CYP2C19 P33261 1/20 0.45
CASP6 P55212 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL8110465 0.84 CASP6 (0.64) SNCACA1CA2CA12CA9
SCHEMBL6839436 0.83 CA12 (0.64) CA1CA2CA12CA9ALDH1A1
SCHEMBL14627308 0.82 ENPP2 (0.51) SNCACA1CA2CA12CA9
SCHEMBL5561256 0.81 SNCA (0.65) SNCACA1CA2CA12ATM
SCHEMBL30233294 0.80 SNCA (0.62) SNCACA1CA2CA12ALDH1A1
SCHEMBL300937 0.80 SNCA (0.62) SNCACA1CA2CA12ALDH1A1
SCHEMBL305423 0.80 SNCA (0.62) SNCACA1CA2CA12ALDH1A1
SCHEMBL12110073 0.80 ALDH1A1 (0.57) SNCAALDH1A1SMN1; SMN2HSD17B10
SCHEMBL5480078 0.79 SNCA (0.64) SNCAATMALDH1A1LMNAGAA
SCHEMBL31252815 0.79 SNCA (0.64) SNCAATMALDH1A1LMNAGAA

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
US-20120056931-A1 MAGENTA COLORING MATTER, INK COMPOSITION, AND COLORED BODY NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-03-08 US disclosed
US-20120056931-A1 MAGENTA COLORING MATTER, INK COMPOSITION, AND COLORED BODY NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-03-08 US disclosed