SCHEMBL1737510

SCHEMBL1737510

COc1cccc(OC)c1CC(=O)NS(=O)(=O)Cc1ccc(N2Cc3c(c(OCC(F)(F)F)c4cccnc4c3OCC(F)(F)F)C2=O)c(C)c1

nearest known ligand 0.87

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 20/20 0.87
TBXA2R P21731 2/20 0.81
PTGFR P43088 2/20 0.81
PTGER3 P43115 2/20 0.81
PTGER2 P43116 2/20 0.81
PTGDR Q13258 2/20 0.81
PTGIR P43119 1/20 0.81

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
SCHEMBL1735777 0.93 PTGER4 (0.91) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL1736082 0.93 PTGER4 (1.00) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL1735752 0.92 PTGER4 (0.78) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL1736106 0.92 PTGER4 (0.90) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL1736071 0.90 PTGER4 (0.87) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL1735006 0.90 PTGER4 (1.00) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL1736107 0.90 PTGER4 (0.81) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL29949084 0.90 PTGER4 (1.00) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL1735032 0.90 PTGER4 (0.86) PTGER4TBXA2RPTGFRPTGER3PTGER2
SCHEMBL1737210 0.89 PTGER4 (0.85) PTGER4TBXA2RPTGFRPTGER3PTGER2

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-1885722-B1 QUINOLINE DERIVATIVES AS EP4 ANTAGONISTS MERCK CANADA INC (CA) 2011-11-16 EP claimed
US-20110262430-A1 NOVEL ANTIBODIES ELLIS JONATHAN HENRY 2011-10-27 US claimed