SCHEMBL14236239

SCHEMBL14236239

CCc1nc2c(F)ccc(OCC(=O)O)c2c(OC(F)F)c1Cc1ccc(S(C)(=O)=O)cc1N

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.57

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
SCHEMBL3784679 0.91 PTGDR2 (0.57) PTGDR2
SCHEMBL3773874 0.87 PTGDR2 (0.70) PTGDR2
SCHEMBL534029 0.86 PTGDR2 (0.64) PTGDR2
SCHEMBL3772299 0.84 PTGDR2 (0.63) PTGDR2
SCHEMBL3775974 0.83 PTGDR2 (0.48) PTGDR2
SCHEMBL3778577 0.83 PTGDR2 (0.62) PTGDR2
SCHEMBL3772564 0.82 PTGDR2 (0.61) PTGDR2
SCHEMBL3778352 0.82 PTGDR2 (0.70) PTGDR2
SCHEMBL3778635 0.82 PTGDR2 (0.60) PTGDR2
SCHEMBL3779349 0.79 PTGDR2 (0.59) 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-1928457-B1 QUINOLINES AND THEIR THERAPEUTIC USE PULMAGEN THERAPEUTICS ASTHMA LTD (GB) 2012-12-12 EP disclosed