SCHEMBL27316638

SCHEMBL27316638

CS(=O)(=O)c1ccc(Cc2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 7/20 0.77
TBXA2R P21731 2/20 0.70
ALDH1A1 P00352 1/20 0.58
MAPT P10636 1/20 0.58

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
SCHEMBL8595578 0.89 TBXAS1 (0.77) TBXAS1TBXA2RALDH1A1MAPT
SCHEMBL8595627 0.89 TBXAS1 (0.73) TBXAS1TBXA2RALDH1A1MAPT
SCHEMBL8593383 0.87 TBXA2R (0.67) TBXAS1TBXA2RALDH1A1MAPT
SCHEMBL8306419 0.87 TBXAS1 (1.00) TBXAS1TBXA2R
SCHEMBL9130164 0.85 TBXA2R (0.81) TBXAS1TBXA2RALDH1A1MAPT
SCHEMBL14327858 0.83 TBXA2R (1.00) TBXAS1TBXA2RALDH1A1MAPT
SCHEMBL8308584 0.81 TBXAS1 (1.00) TBXAS1TBXA2R
SCHEMBL7778977 0.80 TBXA2R (0.69) TBXAS1TBXA2RALDH1A1MAPT
SCHEMBL8309577 0.79 TBXAS1 (0.70) TBXAS1TBXA2R
SCHEMBL8593388 0.78 TBXAS1 (0.58) TBXAS1TBXA2RALDH1A1MAPT

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
CN-1037176-C Benzenealkanoic acids for cardiovascular diseases PFIZER RES & DEV (IE) 1998-01-28 CN disclosed
CN-1087080-A The phenyl alkane acids class of treatment cardiovascular disorder PFIZER RES & DEV (IE) 1994-05-25 CN disclosed