SCHEMBL8306671

SCHEMBL8306671

CCOC(=O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Oc2cccnc2)c1

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 16/20 0.79
TBXA2R P21731 3/20 0.49
TSHR P16473 1/20 0.48
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL8309271 0.92 TBXAS1 (0.79) TBXAS1TBXA2RTSHR
SCHEMBL8304384 0.88 TBXAS1 (1.00) TBXAS1TBXA2R
SCHEMBL8310272 0.88 TBXAS1 (0.77) TBXAS1
SCHEMBL8304294 0.85 TBXAS1 (0.78) TBXAS1TBXA2R
SCHEMBL8309896 0.85 TBXAS1 (0.80) TBXAS1TBXA2R
SCHEMBL8308755 0.83 TBXAS1 (0.67) TBXAS1TBXA2R
SCHEMBL8310499 0.83 TBXAS1 (0.69) TBXAS1TBXA2R
SCHEMBL8307025 0.82 TBXAS1 (0.75) TBXAS1TBXA2R
SCHEMBL8309534 0.81 TBXAS1 (1.00) TBXAS1TBXA2R
SCHEMBL8306012 0.80 TBXAS1 (0.79) TBXAS1TBXA2RTSHR

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 3 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-5705523-A THROMBOXANE A2 SYNTHETASE INHIBITORS PFIZER INC. (US) 1998-01-06 US disclosed
US-5457118-A Pyridine derived agents for cardiovascular diseases PFIZER INC. (US) 1995-10-10 US disclosed