SCHEMBL6174334

SCHEMBL6174334

Cc1ccc(-c2ccc(F)cc2OCc2ccc(F)cc2)n1-c1ccc(OC(F)F)c(C(=O)O)c1

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 20/20 0.82
TBXA2R P21731 1/20 0.64
PTGER4 P35408 1/20 0.64
PTGER3 P43115 1/20 0.64
CYP2C9 P11712 1/20 0.56

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
SCHEMBL5626746 0.94 PTGER1 (0.88) PTGER1TBXA2RPTGER4PTGER3CYP2C9
SCHEMBL5628437 0.91 PTGER1 (0.85) PTGER1TBXA2RPTGER4PTGER3CYP2C9
SCHEMBL6168780 0.90 PTGER1 (0.84) PTGER1TBXA2RPTGER4PTGER3CYP2C9
SCHEMBL5629508 0.90 PTGER1 (1.00) PTGER1TBXA2RPTGER4PTGER3CYP2C9
SCHEMBL6176032 0.86 PTGER1 (0.67) PTGER1TBXA2RPTGER4PTGER3CYP2C9
SCHEMBL5630277 0.85 PTGER1 (0.74) PTGER1TBXA2RPTGER4PTGER3CYP2C9
SCHEMBL5628509 0.83 PTGER1 (1.00) PTGER1TBXA2RPTGER4PTGER3CYP2C9
SCHEMBL5627998 0.83 PTGER1 (0.86) PTGER1TBXA2RPTGER4PTGER3CYP2C9
SCHEMBL5631647 0.83 PTGER1 (1.00) PTGER1CYP2C9
SCHEMBL5629744 0.83 PTGER1 (0.86) PTGER1TBXA2RPTGER4PTGER3CYP2C9

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