SCHEMBL9818992

SCHEMBL9818992

CC1CC(CC(=O)O)c2ccccc2S1(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.41
TP53 P04637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
FFAR1 O14842 1/20 0.34
PTGDR2 Q9Y5Y4 5/20 0.34
EGFR P00533 1/20 0.33
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL9819000 1.00 MAPT (0.41) MAPTATMTP53L3MBTL1FFAR1
SCHEMBL7430025 0.75 MAPT (0.44) MAPTATMTP53L3MBTL1FFAR1
SCHEMBL31326550 0.74 TP53 (0.41) MAPTATMTP53L3MBTL1FFAR1
SCHEMBL21978182 0.74 TP53 (0.41) MAPTATMTP53L3MBTL1FFAR1
SCHEMBL11523163 0.71 FFAR1 (0.43) MAPTATMTP53L3MBTL1FFAR1
SCHEMBL9818881 0.69 GLA (0.38) TP53L3MBTL1FFAR1EGFRPOLB
SCHEMBL9818765 0.69 AKR1B1 (0.45) MAPTTP53L3MBTL1FFAR1POLB
SCHEMBL9818877 0.69 GLA (0.38) TP53L3MBTL1FFAR1EGFRPOLB
SCHEMBL9818767 0.69 AKR1B1 (0.45) MAPTTP53L3MBTL1FFAR1POLB
SCHEMBL11015326 0.68 SLC6A2 (0.42) TP53L3MBTL1FFAR1EGFR

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
EP-0230379-B1 CHROMAN- AND THIOCHROMAN-4-ACETIC ACIDS USEFUL IN THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1991-04-03 EP disclosed