SCHEMBL8308752

SCHEMBL8308752

CCOC(=O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(C(O)c2cccnc2C)c1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 10/20 0.56
TBXA2R P21731 2/20 0.48
CCR9 P51686 1/20 0.44

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
SCHEMBL8304255 0.92 TBXAS1 (0.47) TBXAS1TBXA2R
SCHEMBL9183036 0.90 TBXAS1 (0.66) TBXAS1TBXA2R
SCHEMBL8307940 0.85 CYP4F2 (0.43)
SCHEMBL8309357 0.82 TBXAS1 (0.58) TBXAS1TBXA2R
SCHEMBL8309896 0.82 TBXAS1 (0.80) TBXAS1TBXA2R
SCHEMBL8304781 0.81 PPARG (0.40) TBXAS1
SCHEMBL8308755 0.80 TBXAS1 (0.67) TBXAS1TBXA2R
SCHEMBL8308677 0.80 CYP4F2 (0.39)
SCHEMBL8310272 0.79 TBXAS1 (0.77) TBXAS1
SCHEMBL8307025 0.79 TBXAS1 (0.75) TBXAS1TBXA2R

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-0579618-B1 PYRIDINE- AND IMIDAZOLE-DERIVED AGENTS FOR CARDIOVASCULAR DISEASES PFIZER LTD (GB) 1999-10-13 EP disclosed
US-5457118-A Pyridine derived agents for cardiovascular diseases PFIZER INC. (US) 1995-10-10 US disclosed