SCHEMBL1759190

SCHEMBL1759190

Cc1c(-c2nnc(O)c3ccccc23)c2cc(Cl)ccc2n1CC(=O)O

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 19/20 0.68
PTGS1 P23219 1/20 0.51

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
SCHEMBL1757745 0.90 PTGDR2 (0.69) PTGDR2PTGS1
SCHEMBL1759164 0.89 PTGDR2 (0.61) PTGDR2PTGS1
SCHEMBL1757715 0.88 PTGDR2 (0.66) PTGDR2
SCHEMBL1759392 0.88 PTGDR2 (0.62) PTGDR2
SCHEMBL1757714 0.86 PTGDR2 (0.52) PTGDR2PTGS1
SCHEMBL1757736 0.85 PTGDR2 (0.59) PTGDR2
SCHEMBL1757732 0.85 PTGDR2 (0.58) PTGDR2
SCHEMBL1759473 0.82 PTGDR2 (0.60) PTGDR2PTGS1
SCHEMBL1757334 0.81 PTGDR2 (0.77) PTGDR2PTGS1
SCHEMBL2206147 0.81 PTGDR2 (1.00) 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
WO-2011055270-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS WYETH LLC (US) 2011-05-12 WO disclosed