SCHEMBL6177097

SCHEMBL6177097

CCOC(=O)c1cccc(-n2c(C)ccc2-c2ccc(Br)cc2OCc2ccccc2C)c1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 20/20 0.73
CYP2C9 P11712 2/20 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
SCHEMBL5627129 0.95 PTGER1 (0.82) PTGER1CYP2C9
SCHEMBL5626950 0.88 PTGER1 (0.70) PTGER1CYP2C9
SCHEMBL6176099 0.86 PTGER1 (0.66) PTGER1CYP2C9
SCHEMBL5627987 0.86 PTGER1 (0.82) PTGER1CYP2C9
SCHEMBL5628325 0.86 PTGER1 (0.82) PTGER1CYP2C9
SCHEMBL5627191 0.85 PTGER1 (0.70) PTGER1CYP2C9
SCHEMBL5628100 0.84 PTGER1 (0.72) PTGER1CYP2C9
SCHEMBL5629549 0.84 PTGER1 (1.00) PTGER1CYP2C9
SCHEMBL5628381 0.84 PTGER1 (0.82) PTGER1CYP2C9
SCHEMBL5628795 0.84 PTGER1 (0.82) PTGER1CYP2C9

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-1509499-A1 PYRROLE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LIMITED (GB) 2005-03-02 EP disclosed
WO-2003101959-A1 PYRROLE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LIMITED (GB) 2003-12-11 WO disclosed