SCHEMBL8308660

SCHEMBL8308660

CCOC(=O)CCc1cc(CCN)cc(Cc2cccnc2)c1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 18/20 0.49
CHRNA7 P36544 1/20 0.48
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43

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
SCHEMBL8304942 0.94 TBXAS1 (0.54) TBXAS1CYP4F2CYP4A11
SCHEMBL8309251 0.93 TBXAS1 (0.51) TBXAS1
SCHEMBL8307393 0.89 TBXAS1 (0.62) TBXAS1
SCHEMBL8308006 0.85 CYP4F2 (0.47) TBXAS1CYP4F2CYP4A11
SCHEMBL8702343 0.85 TBXAS1 (0.47) TBXAS1
SCHEMBL11062768 0.85 TBXAS1 (0.66) TBXAS1CYP4F2CYP4A11
SCHEMBL8307041 0.84 TBXAS1 (0.49) TBXAS1CHRNA7CYP4F2CYP4A11
SCHEMBL8702346 0.84 TBXAS1 (0.49) TBXAS1
SCHEMBL3957320 0.84 CYP4F2 (0.55) TBXAS1CYP4F2CYP4A11
SCHEMBL8310249 0.83 TBXAS1 (0.62) TBXAS1

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 5 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
EP-0579618-A1 PYRIDINE- AND IMIDAZOLE-DERIVED AGENTS FOR CARDIOVASCULAR DISEASES Pfizer Limited (GB) 1994-01-26 EP disclosed
WO-1992017451-A1 PYRIDINE- AND IMIDAZOLE-DERIVED AGENTS FOR CARDIOVASCULAR DISEASES PFIZER LIMITED (GB) 1992-10-15 WO disclosed