SCHEMBL4693680

SCHEMBL4693680

COc1cccc(-c2ccc(OCc3cc(OC(=O)O)oc3C)cc2)c1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 18/20 0.74
FFAR1 O14842 1/20 0.52
FFAR4 Q5NUL3 1/20 0.52
PPARD Q03181 1/20 0.48

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
SCHEMBL4692290 0.91 PTGER4 (0.71) PTGER4
SCHEMBL4693788 0.90 PTGER4 (0.70) PTGER4
SCHEMBL4690392 0.89 PTGER4 (0.60) PTGER4
SCHEMBL4691480 0.87 PTGER4 (0.61) PTGER4
SCHEMBL4689374 0.86 PTGER4 (0.59) PTGER4
SCHEMBL4691622 0.85 PTGER4 (0.74) PTGER4
SCHEMBL3543639 0.85 PTGER4 (1.00) PTGER4
SCHEMBL4691910 0.84 PTGER4 (0.60) PTGER4
SCHEMBL4694643 0.83 PTGER4 (0.58) PTGER4
SCHEMBL4690798 0.83 PTGER4 (0.60) PTGER4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603893-B1 EP4 RECEPTOR ANTAGONISTS ASTERAND UK LTD (GB) 2008-05-21 EP claimed