SCHEMBL4564552

SCHEMBL4564552

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

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.39
CA1 P00915 13/20 0.39
CA9 Q16790 9/20 0.39
CA6 P23280 3/20 0.39
CA4 P22748 3/20 0.39
CA5A P35218 3/20 0.39
CA12 O43570 3/20 0.39
CA7 P43166 3/20 0.39
CA5B Q9Y2D0 2/20 0.39
CYP2C9 P11712 1/20 0.39
CA14 Q9ULX7 1/20 0.39
LDHA P00338 1/20 0.35
CDK2 P24941 1/20 0.35
PTGES2 Q9H7Z7 2/20 0.32
STAT3 P40763 1/20 0.32

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
SCHEMBL8679535 0.76 CA2 (0.44) CA2CA1CA9CA6CA4
SCHEMBL253349 0.75 CA2 (0.42) CA2CA1CA9CA6CA4
SCHEMBL6063207 0.72 KDM4E (0.41) CA2CA1CA9CA6CA4
SCHEMBL3284628 0.72 HTR2A (0.48) CA2CA1CA9CA6CA4
SCHEMBL2923475 0.70 CA2 (0.41) CA2CA1CA9CA6CA4
SCHEMBL8428528 0.68 CA2 (0.47) CA2CA1CA9CA6CA4
SCHEMBL2588715 0.68 CA2 (0.43) CA2CA1CA9CA6CA4
SCHEMBL21826752 0.67 CA2 (0.50) CA2CA1CA9CA6CA4
SCHEMBL1106519 0.67 CA1 (0.53) CA2CA1CA9CA6CA4
SCHEMBL29469924 0.67 CA2 (0.50) CA2CA1CA9CA6CA4

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-2094797-A1 INK-RECEPTIVE COATING COMPOSITION Avery Dennison Corporation (US) 2009-09-02 EP claimed
WO-2008070029-A1 INK-RECEPTIVE COATING COMPOSITION AVERY DENNISON CORPORATION (US) 2008-06-12 WO claimed