SCHEMBL6171304

SCHEMBL6171304

CCc1ccc(OCc2ccc(F)cc2)c(-c2ccc(C)n2-c2cc(N)cc(C(=O)OC)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 20/20 0.58
CYP2C9 P11712 1/20 0.55
TBXA2R P21731 1/20 0.51
PTGER4 P35408 1/20 0.51
PTGER3 P43115 1/20 0.51

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
SCHEMBL5627558 0.95 PTGER1 (0.64) PTGER1CYP2C9TBXA2RPTGER4PTGER3
SCHEMBL5631798 0.93 PTGER1 (0.66) PTGER1CYP2C9TBXA2RPTGER4PTGER3
SCHEMBL5628821 0.91 PTGER1 (0.71) PTGER1CYP2C9
SCHEMBL5627630 0.85 PTGER1 (0.74) PTGER1CYP2C9
SCHEMBL6169881 0.85 PTGER1 (0.72) PTGER1CYP2C9TBXA2RPTGER4PTGER3
SCHEMBL5629154 0.84 PTGER1 (0.73) PTGER1CYP2C9
SCHEMBL5627588 0.82 PTGER1 (0.85) PTGER1CYP2C9
SCHEMBL5628921 0.82 PTGER1 (0.85) PTGER1CYP2C9
SCHEMBL5628621 0.82 PTGER1 (0.85) PTGER1CYP2C9
SCHEMBL5627492 0.82 PTGER1 (0.62) 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