SCHEMBL6604469

SCHEMBL6604469

O=C(O)CCCCCCN1C(=O)CCC1C=C[C@@H](O)c1cccc(Oc2cccc(F)c2)c1

nearest known ligand 0.87

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 18/20 0.87
PTGER1 P34995 2/20 0.87
PTGER2 P43116 9/20 0.71
PTGER3 P43115 7/20 0.61

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
SCHEMBL5734001 1.00 PTGER4 (0.87) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5734012 1.00 PTGER4 (0.87) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5734008 1.00 PTGER4 (0.87) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5734005 1.00 PTGER4 (0.87) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5734143 0.94 PTGER4 (0.89) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5734149 0.94 PTGER4 (0.89) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5734135 0.94 PTGER4 (0.89) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5734147 0.94 PTGER4 (0.89) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5733168 0.93 PTGER4 (1.00) PTGER4PTGER1PTGER2PTGER3
SCHEMBL5733158 0.93 PTGER4 (1.00) PTGER4PTGER1PTGER2PTGER3

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-1409455-A1 PROSTAGLANDIN ANALOGUES-AS EP4 RECEPTOR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-21 EP disclosed
WO-2003008377-A1 PROSTAGLANDIN ANALOGUES_AS EP4 RECEPTOR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-01-30 WO disclosed