SCHEMBL6024693

SCHEMBL6024693

Cc1ccc(S(=O)(=O)OC[C@@H](O)CN(Cc2ccccc2)C(CC(=O)O)C(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.40
GAA P10253 2/20 0.40
TAS2R14 Q9NYV8 2/20 0.39
MCHR1 Q99705 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
POLB P06746 1/20 0.39
NR3C1 P04150 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LIMK2 P53671 1/20 0.38
CNR2 P34972 3/20 0.38
ALOX15 P16050 1/20 0.37

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
SCHEMBL6024628 1.00 BACE1 (0.40) BACE1GAATAS2R14MCHR1KMT2A
SCHEMBL3457301 1.00 BACE1 (0.40) BACE1GAATAS2R14MCHR1KMT2A
SCHEMBL3458080 1.00 BACE1 (0.40) BACE1GAATAS2R14MCHR1KMT2A
SCHEMBL3457756 0.83 POLB (0.38) TAS2R14MCHR1POLBNR3C1ALDH1A1
SCHEMBL3458170 0.83 POLB (0.38) TAS2R14MCHR1POLBNR3C1ALDH1A1
SCHEMBL6023715 0.82 POLB (0.38) GAATAS2R14MCHR1POLBNR3C1
SCHEMBL6024794 0.82 POLB (0.38) GAATAS2R14MCHR1POLBNR3C1
SCHEMBL2173598 0.82 LMNA (0.41) BACE1GAATAS2R14POLBALDH1A1
SCHEMBL2173817 0.82 LMNA (0.41) BACE1GAATAS2R14POLBALDH1A1
SCHEMBL3026229 0.79 TAS2R14 (0.46) TAS2R14MCHR1POLBNR3C1ALDH1A1

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-1678167-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES Incyte Corporation (US) 2006-07-12 EP disclosed
WO-2005037826-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES INCYTE CORPORATION (US) 2005-04-28 WO disclosed