SCHEMBL8515162

SCHEMBL8515162

CCOc1c2c(c(OCC)c3ccccc13)C(O)N(c1c(F)cc(CC(=O)O)cc1F)C2=O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 19/20 0.54
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
THRB P10828 1/20 0.39

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
SCHEMBL12011134 0.90 PTGER4 (0.44) PTGER4CYP1A2CYP2D6
SCHEMBL4610403 0.89 PTGER4 (0.64) PTGER4CYP1A2CYP2D6
SCHEMBL2299588 0.84 PTGER4 (0.42) PTGER4CYP1A2CYP2D6
SCHEMBL2937634 0.83 PTGER4 (0.58) PTGER4CYP1A2CYP2D6
SCHEMBL2937290 0.83 PTGER4 (0.58) PTGER4CYP1A2CYP2D6
SCHEMBL3238654 0.83 PTGER4 (0.58) PTGER4CYP1A2CYP2D6
SCHEMBL3231023 0.83 PTGER4 (0.58) PTGER4CYP1A2CYP2D6
SCHEMBL4611048 0.83 PTGER4 (0.66) PTGER4CYP1A2CYP2D6
SCHEMBL2298465 0.82 PTGER4 (0.68) PTGER4CYP1A2CYP2D6THRB
SCHEMBL4611275 0.82 PTGER4 (0.59) PTGER4CYP1A2CYP2D6

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
US-8252833-B2 Benzo (f) isoindol-2-ylphenyl acetic acid derivatives as EP4 receptor agonists GLAXO GROUP LIMITED (GB) 2012-08-28 US disclosed
EP-2457897-A1 BENZO (F) ISOINDOL-2-YLPHENYL ACETIC ACID DERIVATIVES AS EP4 RECEPTOR AGONISTS Glaxo Group Limited (GB) 2012-05-30 EP disclosed