SCHEMBL17818013

SCHEMBL17818013

O=C(O)OC1CCOc2cc(Oc3ccc(C(=O)Nc4cncc(-c5ccc(Cl)cc5)c4)cc3)c(Cl)cc21

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.58

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
SCHEMBL17817966 0.92 PTGDR2 (0.52) PTGDR2
SCHEMBL2132320 0.89 PTGDR2 (0.73) PTGDR2
SCHEMBL17818024 0.88 PTGDR2 (0.59) PTGDR2
SCHEMBL17817986 0.87 PTGDR2 (0.65) PTGDR2
SCHEMBL17818094 0.87 PTGDR2 (0.59) PTGDR2
SCHEMBL17818052 0.85 PTGDR2 (0.59) PTGDR2
SCHEMBL17818019 0.85 PTGDR2 (0.59) PTGDR2
SCHEMBL15949571 0.85 PTGDR2 (0.80) PTGDR2
SCHEMBL17818028 0.85 PTGDR2 (0.62) PTGDR2
SCHEMBL17817974 0.84 PTGDR2 (0.63) 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