SCHEMBL8307967

SCHEMBL8307967

CCOC(=O)CCc1cc(CCNS(=O)(=O)C2CCCCC2)cc(Cc2cccnc2)c1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 19/20 0.77
TSHR P16473 1/20 0.41

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
SCHEMBL8309045 0.88 TBXAS1 (0.60) TBXAS1TSHR
SCHEMBL9178744 0.87 TBXAS1 (1.00) TBXAS1
SCHEMBL8310249 0.85 TBXAS1 (0.62) TBXAS1TSHR
SCHEMBL8310093 0.84 TBXAS1 (0.55) TBXAS1TSHR
SCHEMBL8309043 0.84 TBXAS1 (0.77) TBXAS1TSHR
SCHEMBL8307370 0.83 TBXAS1 (0.77) TBXAS1TSHR
SCHEMBL8305169 0.83 TBXAS1 (0.53) TBXAS1TSHR
SCHEMBL8304634 0.83 TBXAS1 (0.79) TBXAS1TSHR
SCHEMBL8304630 0.83 TBXAS1 (0.60) TBXAS1TSHR
SCHEMBL8304728 0.83 TBXAS1 (0.77) TBXAS1TSHR

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