SCHEMBL17818062

SCHEMBL17818062

O=C(O)OC1CCOc2cc(Oc3ccc(C(=O)Nc4ccc(-c5ccc(C(F)(F)F)cc5Cl)nn4)cc3)c(Cl)cc21

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.52

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
SCHEMBL17818077 0.94 PTGDR2 (0.49) PTGDR2
SCHEMBL17817964 0.91 PTGDR2 (0.55) PTGDR2
SCHEMBL17818000 0.90 PTGDR2 (0.53) PTGDR2
SCHEMBL2129938 0.90 PTGDR2 (0.64) PTGDR2
SCHEMBL17818010 0.88 PTGDR2 (0.52) PTGDR2
SCHEMBL17818002 0.88 PTGDR2 (0.55) PTGDR2
SCHEMBL2130304 0.87 PTGDR2 (0.62) PTGDR2
SCHEMBL17818061 0.87 PTGDR2 (0.52) PTGDR2
SCHEMBL17817974 0.86 PTGDR2 (0.63) PTGDR2
SCHEMBL17818011 0.85 PTGDR2 (0.57) PTGDR2

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-2379535-B1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES ARRAY BIOPHARMA INC (US) 2016-06-15 EP claimed