SCHEMBL8404548

SCHEMBL8404548

Cc1cc2cc(Cl)c(Cl)cc2cc1S(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
GLP1R P43220 11/20 0.38
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL8404747 0.87 PTGS2 (0.37) L3MBTL1ALDH1A1
SCHEMBL8404543 0.87 L3MBTL1 (0.37) L3MBTL1GLP1RALDH1A1LMNA
SCHEMBL8404545 0.87 PTGS2 (0.37) L3MBTL1ALDH1A1
SCHEMBL8404549 0.87 L3MBTL1 (0.37) L3MBTL1GLP1RALDH1A1LMNA
SCHEMBL8404547 0.82 CA1 (0.42) L3MBTL1ALDH1A1LMNA
SCHEMBL8404310 0.81 GAA (0.42) L3MBTL1NPSR1
SCHEMBL8404314 0.81 GAA (0.42) L3MBTL1NPSR1
SCHEMBL8404745 0.79 L3MBTL1 (0.42) L3MBTL1ALDH1A1
SCHEMBL8404554 0.79 L3MBTL1 (0.42) L3MBTL1ALDH1A1LMNA
SCHEMBL2633667 0.78 SOD1 (0.47) L3MBTL1

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-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 US disclosed