SCHEMBL7679654

SCHEMBL7679654

CCC1(CC)c2ccccc2S(=O)(=O)N1CCCCl

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
CA9 Q16790 5/20 0.35
CA12 O43570 4/20 0.35
ELANE P08246 1/20 0.32
TP53 P04637 1/20 0.31
CA2 P00918 1/20 0.31
HSD11B1 P28845 1/20 0.31

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
SCHEMBL7686476 0.91 GAA (0.35) GAACA9CA12ELANETP53
SCHEMBL7686603 0.82 GAA (0.35) GAACA9CA12ELANETP53
SCHEMBL7954706 0.73 ELANE (0.35) GAACA9CA12ELANETP53
SCHEMBL7686165 0.72 HTR7 (0.54)
SCHEMBL7677803 0.68 HTR7 (0.51)
SCHEMBL23518159 0.67 CA9 (0.41) GAACA9CA12ELANETP53
SCHEMBL6996410 0.65 LMNA (0.34)
SCHEMBL24133108 0.63 CA9 (0.39) GAACA9CA12ELANETP53
SCHEMBL7683391 0.62 TP53 (0.33) GAACA9CA12ELANETP53
SCHEMBL6999769 0.61 LMNA (0.33)

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
US-6346622-B1 ENANTIOMORPHS AND ISOMERS ABBOTT LABORATORIES 2002-02-12 US disclosed