SCHEMBL4694650

SCHEMBL4694650

Cc1c(COc2ccc(-c3ccccc3)cc2)coc1C=CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 15/20 0.52
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL3537246 0.77 PTGER4 (0.66) PTGER4
SCHEMBL3537242 0.77 PTGER4 (0.66) PTGER4
SCHEMBL3531764 0.69 PTGER4 (0.55) PTGER4
SCHEMBL3536176 0.69 PTGER4 (0.67) PTGER4
SCHEMBL3536178 0.69 PTGER4 (0.67) PTGER4
SCHEMBL8173827 0.69 KDM4E (0.73) PTGER4KDM4ESMN1; SMN2
SCHEMBL8173830 0.69 KDM4E (0.73) PTGER4KDM4ESMN1; SMN2
SCHEMBL1756460 0.69 PTGER4 (1.00) PTGER4
SCHEMBL4693788 0.68 PTGER4 (0.70) PTGER4
SCHEMBL1161220 0.67 KDM4E (0.74) PTGER4KDM4ESMN1; SMN2

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